data_34537 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 34537 _Entry.Title ; TFIIS N-terminal domain (TND) from human LEDGF/p75 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2020-07-23 _Entry.Accession_date 2020-07-23 _Entry.Last_release_date 2020-08-17 _Entry.Original_release_date 2020-08-17 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'SOLUTION NMR' _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 V. Veverka V. . . . 34537 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID TRANSCRIPTION . 34537 'chromatin reader' . 34537 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 34537 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 405 34537 '15N chemical shifts' 97 34537 '1H chemical shifts' 687 34537 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2022-06-15 2020-07-23 update BMRB 'update entry citation' 34537 1 . . 2021-11-28 2020-07-23 original author 'original release' 34537 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6ZV0 'BMRB Entry Tracking System' 34537 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 34537 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 34822292 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; A ubiquitous disordered protein interaction module orchestrates transcription elongation ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Science _Citation.Journal_name_full 'Science (New York, N.Y.)' _Citation.Journal_volume 374 _Citation.Journal_issue 6571 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1095-9203 _Citation.Journal_CSD 0353 _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 1113 _Citation.Page_last 1121 _Citation.Year 2021 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Katerina Cermakova K. . . . 34537 1 2 Jonas Demeulemeester J. . . . 34537 1 3 Vanda Lux V. . . . 34537 1 4 Monika Nedomova M. . . . 34537 1 5 Seth Goldman S. R. . . 34537 1 6 Eric Smith E. A. . . 34537 1 7 Pavel Srb P. . . . 34537 1 8 Rozalie Hexnerova R. . . . 34537 1 9 Milan Fabry M. . . . 34537 1 10 Marcela Madlikova M. . . . 34537 1 11 Magdalena Horejsi M. . . . 34537 1 12 Jan 'De Rijck' J. . . . 34537 1 13 Zeger Debyser Z. . . . 34537 1 14 Karen Adelman K. . . . 34537 1 15 'H Courtney' Hodges H. C. . . 34537 1 16 Vaclav Veverka V. . . . 34537 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 34537 _Assembly.ID 1 _Assembly.Name 'PC4 and SFRS1-interacting protein' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 unit_1 1 $entity_1 A A yes . . . . . . 34537 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 34537 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; SNAASETSMDSRLQRIHAEI KNSLKIDNLDVNRCIEALDE LASLQVTMQQAQKHTEMITT LKKIRRFKVSQVIMEKSTML YNKFKNMFLVGE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 92 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 10648.392 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'CLL-associated antigen KW-7' common 34537 1 'DFS 70' common 34537 1 'Dense fine speckles 70 kDa protein' common 34537 1 'Lens epithelium-derived growth factor' common 34537 1 'Transcriptional coactivator p75/p52' common 34537 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 340 SER . 34537 1 2 341 ASN . 34537 1 3 342 ALA . 34537 1 4 343 ALA . 34537 1 5 344 SER . 34537 1 6 345 GLU . 34537 1 7 346 THR . 34537 1 8 347 SER . 34537 1 9 348 MET . 34537 1 10 349 ASP . 34537 1 11 350 SER . 34537 1 12 351 ARG . 34537 1 13 352 LEU . 34537 1 14 353 GLN . 34537 1 15 354 ARG . 34537 1 16 355 ILE . 34537 1 17 356 HIS . 34537 1 18 357 ALA . 34537 1 19 358 GLU . 34537 1 20 359 ILE . 34537 1 21 360 LYS . 34537 1 22 361 ASN . 34537 1 23 362 SER . 34537 1 24 363 LEU . 34537 1 25 364 LYS . 34537 1 26 365 ILE . 34537 1 27 366 ASP . 34537 1 28 367 ASN . 34537 1 29 368 LEU . 34537 1 30 369 ASP . 34537 1 31 370 VAL . 34537 1 32 371 ASN . 34537 1 33 372 ARG . 34537 1 34 373 CYS . 34537 1 35 374 ILE . 34537 1 36 375 GLU . 34537 1 37 376 ALA . 34537 1 38 377 LEU . 34537 1 39 378 ASP . 34537 1 40 379 GLU . 34537 1 41 380 LEU . 34537 1 42 381 ALA . 34537 1 43 382 SER . 34537 1 44 383 LEU . 34537 1 45 384 GLN . 34537 1 46 385 VAL . 34537 1 47 386 THR . 34537 1 48 387 MET . 34537 1 49 388 GLN . 34537 1 50 389 GLN . 34537 1 51 390 ALA . 34537 1 52 391 GLN . 34537 1 53 392 LYS . 34537 1 54 393 HIS . 34537 1 55 394 THR . 34537 1 56 395 GLU . 34537 1 57 396 MET . 34537 1 58 397 ILE . 34537 1 59 398 THR . 34537 1 60 399 THR . 34537 1 61 400 LEU . 34537 1 62 401 LYS . 34537 1 63 402 LYS . 34537 1 64 403 ILE . 34537 1 65 404 ARG . 34537 1 66 405 ARG . 34537 1 67 406 PHE . 34537 1 68 407 LYS . 34537 1 69 408 VAL . 34537 1 70 409 SER . 34537 1 71 410 GLN . 34537 1 72 411 VAL . 34537 1 73 412 ILE . 34537 1 74 413 MET . 34537 1 75 414 GLU . 34537 1 76 415 LYS . 34537 1 77 416 SER . 34537 1 78 417 THR . 34537 1 79 418 MET . 34537 1 80 419 LEU . 34537 1 81 420 TYR . 34537 1 82 421 ASN . 34537 1 83 422 LYS . 34537 1 84 423 PHE . 34537 1 85 424 LYS . 34537 1 86 425 ASN . 34537 1 87 426 MET . 34537 1 88 427 PHE . 34537 1 89 428 LEU . 34537 1 90 429 VAL . 34537 1 91 430 GLY . 34537 1 92 431 GLU . 34537 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . SER 1 1 34537 1 . ASN 2 2 34537 1 . ALA 3 3 34537 1 . ALA 4 4 34537 1 . SER 5 5 34537 1 . GLU 6 6 34537 1 . THR 7 7 34537 1 . SER 8 8 34537 1 . MET 9 9 34537 1 . ASP 10 10 34537 1 . SER 11 11 34537 1 . ARG 12 12 34537 1 . LEU 13 13 34537 1 . GLN 14 14 34537 1 . ARG 15 15 34537 1 . ILE 16 16 34537 1 . HIS 17 17 34537 1 . ALA 18 18 34537 1 . GLU 19 19 34537 1 . ILE 20 20 34537 1 . LYS 21 21 34537 1 . ASN 22 22 34537 1 . SER 23 23 34537 1 . LEU 24 24 34537 1 . LYS 25 25 34537 1 . ILE 26 26 34537 1 . ASP 27 27 34537 1 . ASN 28 28 34537 1 . LEU 29 29 34537 1 . ASP 30 30 34537 1 . VAL 31 31 34537 1 . ASN 32 32 34537 1 . ARG 33 33 34537 1 . CYS 34 34 34537 1 . ILE 35 35 34537 1 . GLU 36 36 34537 1 . ALA 37 37 34537 1 . LEU 38 38 34537 1 . ASP 39 39 34537 1 . GLU 40 40 34537 1 . LEU 41 41 34537 1 . ALA 42 42 34537 1 . SER 43 43 34537 1 . LEU 44 44 34537 1 . GLN 45 45 34537 1 . VAL 46 46 34537 1 . THR 47 47 34537 1 . MET 48 48 34537 1 . GLN 49 49 34537 1 . GLN 50 50 34537 1 . ALA 51 51 34537 1 . GLN 52 52 34537 1 . LYS 53 53 34537 1 . HIS 54 54 34537 1 . THR 55 55 34537 1 . GLU 56 56 34537 1 . MET 57 57 34537 1 . ILE 58 58 34537 1 . THR 59 59 34537 1 . THR 60 60 34537 1 . LEU 61 61 34537 1 . LYS 62 62 34537 1 . LYS 63 63 34537 1 . ILE 64 64 34537 1 . ARG 65 65 34537 1 . ARG 66 66 34537 1 . PHE 67 67 34537 1 . LYS 68 68 34537 1 . VAL 69 69 34537 1 . SER 70 70 34537 1 . GLN 71 71 34537 1 . VAL 72 72 34537 1 . ILE 73 73 34537 1 . MET 74 74 34537 1 . GLU 75 75 34537 1 . LYS 76 76 34537 1 . SER 77 77 34537 1 . THR 78 78 34537 1 . MET 79 79 34537 1 . LEU 80 80 34537 1 . TYR 81 81 34537 1 . ASN 82 82 34537 1 . LYS 83 83 34537 1 . PHE 84 84 34537 1 . LYS 85 85 34537 1 . ASN 86 86 34537 1 . MET 87 87 34537 1 . PHE 88 88 34537 1 . LEU 89 89 34537 1 . VAL 90 90 34537 1 . GLY 91 91 34537 1 . GLU 92 92 34537 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 34537 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . 'PSIP1, DFS70, LEDGF, PSIP2' . 34537 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 34537 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . . . . . 34537 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 34537 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.6 mM [U-13C; U-15N] LEDGF/p75, 25 mM [U-2H] TRIS, 200 mM sodium chloride, 1 mM TCEP, 95% H2O/5% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 LEDGF/p75 '[U-13C; U-15N]' . . 1 $entity_1 . . 0.6 . . mM . . . . 34537 1 2 TRIS [U-2H] . . . . . . 25 . . mM . . . . 34537 1 3 'sodium chloride' 'natural abundance' . . . . . . 200 . . mM . . . . 34537 1 4 TCEP 'natural abundance' . . . . . . 1 . . mM . . . . 34537 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 34537 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 225 . mM 34537 1 pH 7.4 . pH 34537 1 pressure 1 . atm 34537 1 temperature 298 . K 34537 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 34537 _Software.ID 1 _Software.Type . _Software.Name Sparky _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 34537 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 34537 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 34537 _Software.ID 2 _Software.Type . _Software.Name CYANA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 34537 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'structure calculation' . 34537 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 34537 _Software.ID 3 _Software.Type . _Software.Name YASARA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID YASARA . . 34537 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID refinement . 34537 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 34537 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III HD' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 850 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 34537 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker 'AVANCE III HD' . 850 . . . 34537 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 34537 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34537 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34537 1 3 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34537 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34537 1 5 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34537 1 6 '3D HCCH-TOCSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34537 1 7 '3D HBHA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34537 1 8 '3D HN(CO)CA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34537 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 34537 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.251449530 . . . . . 34537 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 34537 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.101329118 . . . . . 34537 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 34537 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 34537 1 2 '2D 1H-13C HSQC' . . . 34537 1 3 '3D HNCACB' . . . 34537 1 4 '3D CBCA(CO)NH' . . . 34537 1 5 '3D HNCO' . . . 34537 1 6 '3D HCCH-TOCSY' . . . 34537 1 7 '3D HBHA(CO)NH' . . . 34537 1 8 '3D HN(CO)CA' . . . 34537 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 ASN HA H 1 4.778 0.000 . . . . . . A 341 ASN HA . 34537 1 2 . 1 . 1 2 2 ASN HB2 H 1 2.880 0.000 . . . . . . A 341 ASN HB2 . 34537 1 3 . 1 . 1 2 2 ASN HB3 H 1 2.795 0.000 . . . . . . A 341 ASN HB3 . 34537 1 4 . 1 . 1 2 2 ASN C C 13 175.092 0.000 . . . . . . A 341 ASN C . 34537 1 5 . 1 . 1 2 2 ASN CA C 13 53.636 0.000 . . . . . . A 341 ASN CA . 34537 1 6 . 1 . 1 2 2 ASN CB C 13 39.077 0.000 . . . . . . A 341 ASN CB . 34537 1 7 . 1 . 1 3 3 ALA H H 1 8.418 0.003 . . . . . . A 342 ALA H . 34537 1 8 . 1 . 1 3 3 ALA HA H 1 4.292 0.000 . . . . . . A 342 ALA HA . 34537 1 9 . 1 . 1 3 3 ALA HB1 H 1 1.397 0.000 . . . . . . A 342 ALA HB1 . 34537 1 10 . 1 . 1 3 3 ALA HB2 H 1 1.397 0.000 . . . . . . A 342 ALA HB2 . 34537 1 11 . 1 . 1 3 3 ALA HB3 H 1 1.397 0.000 . . . . . . A 342 ALA HB3 . 34537 1 12 . 1 . 1 3 3 ALA C C 13 177.824 0.000 . . . . . . A 342 ALA C . 34537 1 13 . 1 . 1 3 3 ALA CA C 13 53.094 0.014 . . . . . . A 342 ALA CA . 34537 1 14 . 1 . 1 3 3 ALA CB C 13 19.117 0.000 . . . . . . A 342 ALA CB . 34537 1 15 . 1 . 1 3 3 ALA N N 15 124.858 0.025 . . . . . . A 342 ALA N . 34537 1 16 . 1 . 1 4 4 ALA H H 1 8.315 0.004 . . . . . . A 343 ALA H . 34537 1 17 . 1 . 1 4 4 ALA HA H 1 4.325 0.000 . . . . . . A 343 ALA HA . 34537 1 18 . 1 . 1 4 4 ALA HB1 H 1 1.422 0.000 . . . . . . A 343 ALA HB1 . 34537 1 19 . 1 . 1 4 4 ALA HB2 H 1 1.422 0.000 . . . . . . A 343 ALA HB2 . 34537 1 20 . 1 . 1 4 4 ALA HB3 H 1 1.422 0.000 . . . . . . A 343 ALA HB3 . 34537 1 21 . 1 . 1 4 4 ALA C C 13 178.223 0.000 . . . . . . A 343 ALA C . 34537 1 22 . 1 . 1 4 4 ALA CA C 13 53.004 0.035 . . . . . . A 343 ALA CA . 34537 1 23 . 1 . 1 4 4 ALA CB C 13 19.021 0.008 . . . . . . A 343 ALA CB . 34537 1 24 . 1 . 1 4 4 ALA N N 15 123.081 0.016 . . . . . . A 343 ALA N . 34537 1 25 . 1 . 1 5 5 SER H H 1 8.220 0.001 . . . . . . A 344 SER H . 34537 1 26 . 1 . 1 5 5 SER HA H 1 4.420 0.000 . . . . . . A 344 SER HA . 34537 1 27 . 1 . 1 5 5 SER HB2 H 1 3.948 0.000 . . . . . . A 344 SER HB2 . 34537 1 28 . 1 . 1 5 5 SER HB3 H 1 3.892 0.000 . . . . . . A 344 SER HB3 . 34537 1 29 . 1 . 1 5 5 SER C C 13 175.078 0.000 . . . . . . A 344 SER C . 34537 1 30 . 1 . 1 5 5 SER CA C 13 58.808 0.068 . . . . . . A 344 SER CA . 34537 1 31 . 1 . 1 5 5 SER CB C 13 63.815 0.065 . . . . . . A 344 SER CB . 34537 1 32 . 1 . 1 5 5 SER N N 15 114.774 0.018 . . . . . . A 344 SER N . 34537 1 33 . 1 . 1 6 6 GLU H H 1 8.443 0.002 . . . . . . A 345 GLU H . 34537 1 34 . 1 . 1 6 6 GLU HA H 1 4.392 0.004 . . . . . . A 345 GLU HA . 34537 1 35 . 1 . 1 6 6 GLU HB2 H 1 2.123 0.000 . . . . . . A 345 GLU HB2 . 34537 1 36 . 1 . 1 6 6 GLU HB3 H 1 2.029 0.000 . . . . . . A 345 GLU HB3 . 34537 1 37 . 1 . 1 6 6 GLU HG2 H 1 2.323 0.000 . . . . . . A 345 GLU HG2 . 34537 1 38 . 1 . 1 6 6 GLU HG3 H 1 2.286 0.000 . . . . . . A 345 GLU HG3 . 34537 1 39 . 1 . 1 6 6 GLU C C 13 177.230 0.000 . . . . . . A 345 GLU C . 34537 1 40 . 1 . 1 6 6 GLU CA C 13 57.388 0.067 . . . . . . A 345 GLU CA . 34537 1 41 . 1 . 1 6 6 GLU CB C 13 30.203 0.028 . . . . . . A 345 GLU CB . 34537 1 42 . 1 . 1 6 6 GLU CG C 13 36.353 0.027 . . . . . . A 345 GLU CG . 34537 1 43 . 1 . 1 6 6 GLU N N 15 123.047 0.013 . . . . . . A 345 GLU N . 34537 1 44 . 1 . 1 7 7 THR H H 1 8.327 0.001 . . . . . . A 346 THR H . 34537 1 45 . 1 . 1 7 7 THR HA H 1 4.408 0.002 . . . . . . A 346 THR HA . 34537 1 46 . 1 . 1 7 7 THR HB H 1 4.357 0.000 . . . . . . A 346 THR HB . 34537 1 47 . 1 . 1 7 7 THR HG21 H 1 1.288 0.000 . . . . . . A 346 THR HG21 . 34537 1 48 . 1 . 1 7 7 THR HG22 H 1 1.288 0.000 . . . . . . A 346 THR HG22 . 34537 1 49 . 1 . 1 7 7 THR HG23 H 1 1.288 0.000 . . . . . . A 346 THR HG23 . 34537 1 50 . 1 . 1 7 7 THR CA C 13 62.548 0.032 . . . . . . A 346 THR CA . 34537 1 51 . 1 . 1 7 7 THR CB C 13 69.920 0.035 . . . . . . A 346 THR CB . 34537 1 52 . 1 . 1 7 7 THR CG2 C 13 21.802 0.000 . . . . . . A 346 THR CG2 . 34537 1 53 . 1 . 1 7 7 THR N N 15 114.411 0.017 . . . . . . A 346 THR N . 34537 1 54 . 1 . 1 9 9 MET HA H 1 4.445 0.007 . . . . . . A 348 MET HA . 34537 1 55 . 1 . 1 9 9 MET HB2 H 1 2.221 0.000 . . . . . . A 348 MET HB2 . 34537 1 56 . 1 . 1 9 9 MET HB3 H 1 2.023 0.000 . . . . . . A 348 MET HB3 . 34537 1 57 . 1 . 1 9 9 MET HG2 H 1 2.646 0.003 . . . . . . A 348 MET HG2 . 34537 1 58 . 1 . 1 9 9 MET HG3 H 1 2.494 0.000 . . . . . . A 348 MET HG3 . 34537 1 59 . 1 . 1 9 9 MET HE1 H 1 2.113 0.000 . . . . . . A 348 MET HE1 . 34537 1 60 . 1 . 1 9 9 MET HE2 H 1 2.113 0.000 . . . . . . A 348 MET HE2 . 34537 1 61 . 1 . 1 9 9 MET HE3 H 1 2.113 0.000 . . . . . . A 348 MET HE3 . 34537 1 62 . 1 . 1 9 9 MET C C 13 177.894 0.000 . . . . . . A 348 MET C . 34537 1 63 . 1 . 1 9 9 MET CA C 13 57.303 0.080 . . . . . . A 348 MET CA . 34537 1 64 . 1 . 1 9 9 MET CB C 13 31.222 0.094 . . . . . . A 348 MET CB . 34537 1 65 . 1 . 1 9 9 MET CG C 13 32.233 0.048 . . . . . . A 348 MET CG . 34537 1 66 . 1 . 1 9 9 MET CE C 13 16.839 0.000 . . . . . . A 348 MET CE . 34537 1 67 . 1 . 1 10 10 ASP H H 1 8.361 0.003 . . . . . . A 349 ASP H . 34537 1 68 . 1 . 1 10 10 ASP HA H 1 4.447 0.000 . . . . . . A 349 ASP HA . 34537 1 69 . 1 . 1 10 10 ASP HB2 H 1 2.829 0.000 . . . . . . A 349 ASP HB2 . 34537 1 70 . 1 . 1 10 10 ASP HB3 H 1 2.829 0.000 . . . . . . A 349 ASP HB3 . 34537 1 71 . 1 . 1 10 10 ASP C C 13 178.216 0.000 . . . . . . A 349 ASP C . 34537 1 72 . 1 . 1 10 10 ASP CA C 13 58.367 0.002 . . . . . . A 349 ASP CA . 34537 1 73 . 1 . 1 10 10 ASP CB C 13 41.062 0.047 . . . . . . A 349 ASP CB . 34537 1 74 . 1 . 1 10 10 ASP N N 15 118.763 0.019 . . . . . . A 349 ASP N . 34537 1 75 . 1 . 1 11 11 SER H H 1 7.982 0.002 . . . . . . A 350 SER H . 34537 1 76 . 1 . 1 11 11 SER HA H 1 4.247 0.000 . . . . . . A 350 SER HA . 34537 1 77 . 1 . 1 11 11 SER HB2 H 1 3.993 0.000 . . . . . . A 350 SER HB2 . 34537 1 78 . 1 . 1 11 11 SER HB3 H 1 3.993 0.000 . . . . . . A 350 SER HB3 . 34537 1 79 . 1 . 1 11 11 SER C C 13 177.291 0.000 . . . . . . A 350 SER C . 34537 1 80 . 1 . 1 11 11 SER CA C 13 61.648 0.057 . . . . . . A 350 SER CA . 34537 1 81 . 1 . 1 11 11 SER CB C 13 62.798 0.072 . . . . . . A 350 SER CB . 34537 1 82 . 1 . 1 11 11 SER N N 15 114.503 0.016 . . . . . . A 350 SER N . 34537 1 83 . 1 . 1 12 12 ARG H H 1 8.061 0.005 . . . . . . A 351 ARG H . 34537 1 84 . 1 . 1 12 12 ARG HA H 1 4.072 0.006 . . . . . . A 351 ARG HA . 34537 1 85 . 1 . 1 12 12 ARG HB2 H 1 1.966 0.003 . . . . . . A 351 ARG HB2 . 34537 1 86 . 1 . 1 12 12 ARG HB3 H 1 1.966 0.003 . . . . . . A 351 ARG HB3 . 34537 1 87 . 1 . 1 12 12 ARG HG2 H 1 1.806 0.000 . . . . . . A 351 ARG HG2 . 34537 1 88 . 1 . 1 12 12 ARG HG3 H 1 1.588 0.000 . . . . . . A 351 ARG HG3 . 34537 1 89 . 1 . 1 12 12 ARG HD2 H 1 3.170 0.000 . . . . . . A 351 ARG HD2 . 34537 1 90 . 1 . 1 12 12 ARG HD3 H 1 3.170 0.000 . . . . . . A 351 ARG HD3 . 34537 1 91 . 1 . 1 12 12 ARG C C 13 178.454 0.000 . . . . . . A 351 ARG C . 34537 1 92 . 1 . 1 12 12 ARG CA C 13 59.807 0.039 . . . . . . A 351 ARG CA . 34537 1 93 . 1 . 1 12 12 ARG CB C 13 30.479 0.062 . . . . . . A 351 ARG CB . 34537 1 94 . 1 . 1 12 12 ARG CG C 13 27.230 0.059 . . . . . . A 351 ARG CG . 34537 1 95 . 1 . 1 12 12 ARG CD C 13 43.943 0.000 . . . . . . A 351 ARG CD . 34537 1 96 . 1 . 1 12 12 ARG N N 15 123.788 0.014 . . . . . . A 351 ARG N . 34537 1 97 . 1 . 1 13 13 LEU H H 1 8.439 0.002 . . . . . . A 352 LEU H . 34537 1 98 . 1 . 1 13 13 LEU HA H 1 3.827 0.002 . . . . . . A 352 LEU HA . 34537 1 99 . 1 . 1 13 13 LEU HB2 H 1 1.292 0.000 . . . . . . A 352 LEU HB2 . 34537 1 100 . 1 . 1 13 13 LEU HB3 H 1 0.679 0.000 . . . . . . A 352 LEU HB3 . 34537 1 101 . 1 . 1 13 13 LEU HG H 1 1.593 0.000 . . . . . . A 352 LEU HG . 34537 1 102 . 1 . 1 13 13 LEU HD11 H 1 0.373 0.000 . . . . . . A 352 LEU HD11 . 34537 1 103 . 1 . 1 13 13 LEU HD12 H 1 0.373 0.000 . . . . . . A 352 LEU HD12 . 34537 1 104 . 1 . 1 13 13 LEU HD13 H 1 0.373 0.000 . . . . . . A 352 LEU HD13 . 34537 1 105 . 1 . 1 13 13 LEU HD21 H 1 0.536 0.000 . . . . . . A 352 LEU HD21 . 34537 1 106 . 1 . 1 13 13 LEU HD22 H 1 0.536 0.000 . . . . . . A 352 LEU HD22 . 34537 1 107 . 1 . 1 13 13 LEU HD23 H 1 0.536 0.000 . . . . . . A 352 LEU HD23 . 34537 1 108 . 1 . 1 13 13 LEU C C 13 179.565 0.000 . . . . . . A 352 LEU C . 34537 1 109 . 1 . 1 13 13 LEU CA C 13 58.204 0.040 . . . . . . A 352 LEU CA . 34537 1 110 . 1 . 1 13 13 LEU CB C 13 40.594 0.068 . . . . . . A 352 LEU CB . 34537 1 111 . 1 . 1 13 13 LEU CG C 13 26.580 0.092 . . . . . . A 352 LEU CG . 34537 1 112 . 1 . 1 13 13 LEU CD1 C 13 25.352 0.000 . . . . . . A 352 LEU CD1 . 34537 1 113 . 1 . 1 13 13 LEU CD2 C 13 23.340 0.000 . . . . . . A 352 LEU CD2 . 34537 1 114 . 1 . 1 13 13 LEU N N 15 118.411 0.014 . . . . . . A 352 LEU N . 34537 1 115 . 1 . 1 14 14 GLN H H 1 8.208 0.003 . . . . . . A 353 GLN H . 34537 1 116 . 1 . 1 14 14 GLN HA H 1 4.272 0.000 . . . . . . A 353 GLN HA . 34537 1 117 . 1 . 1 14 14 GLN HB2 H 1 2.322 0.000 . . . . . . A 353 GLN HB2 . 34537 1 118 . 1 . 1 14 14 GLN HB3 H 1 2.229 0.000 . . . . . . A 353 GLN HB3 . 34537 1 119 . 1 . 1 14 14 GLN HG2 H 1 2.737 0.000 . . . . . . A 353 GLN HG2 . 34537 1 120 . 1 . 1 14 14 GLN HG3 H 1 2.589 0.000 . . . . . . A 353 GLN HG3 . 34537 1 121 . 1 . 1 14 14 GLN HE22 H 1 7.538 0.000 . . . . . . A 353 GLN HE22 . 34537 1 122 . 1 . 1 14 14 GLN C C 13 179.200 0.000 . . . . . . A 353 GLN C . 34537 1 123 . 1 . 1 14 14 GLN CA C 13 59.597 0.030 . . . . . . A 353 GLN CA . 34537 1 124 . 1 . 1 14 14 GLN CB C 13 28.398 0.033 . . . . . . A 353 GLN CB . 34537 1 125 . 1 . 1 14 14 GLN CG C 13 34.401 0.048 . . . . . . A 353 GLN CG . 34537 1 126 . 1 . 1 14 14 GLN N N 15 119.122 0.023 . . . . . . A 353 GLN N . 34537 1 127 . 1 . 1 14 14 GLN NE2 N 15 111.370 0.000 . . . . . . A 353 GLN NE2 . 34537 1 128 . 1 . 1 15 15 ARG H H 1 7.979 0.001 . . . . . . A 354 ARG H . 34537 1 129 . 1 . 1 15 15 ARG HA H 1 4.175 0.000 . . . . . . A 354 ARG HA . 34537 1 130 . 1 . 1 15 15 ARG HB2 H 1 1.950 0.002 . . . . . . A 354 ARG HB2 . 34537 1 131 . 1 . 1 15 15 ARG HB3 H 1 2.075 0.000 . . . . . . A 354 ARG HB3 . 34537 1 132 . 1 . 1 15 15 ARG HG2 H 1 1.754 0.000 . . . . . . A 354 ARG HG2 . 34537 1 133 . 1 . 1 15 15 ARG HG3 H 1 1.642 0.000 . . . . . . A 354 ARG HG3 . 34537 1 134 . 1 . 1 15 15 ARG HD2 H 1 3.285 0.000 . . . . . . A 354 ARG HD2 . 34537 1 135 . 1 . 1 15 15 ARG HD3 H 1 3.180 0.000 . . . . . . A 354 ARG HD3 . 34537 1 136 . 1 . 1 15 15 ARG C C 13 178.740 0.000 . . . . . . A 354 ARG C . 34537 1 137 . 1 . 1 15 15 ARG CA C 13 59.744 0.044 . . . . . . A 354 ARG CA . 34537 1 138 . 1 . 1 15 15 ARG CB C 13 28.988 0.047 . . . . . . A 354 ARG CB . 34537 1 139 . 1 . 1 15 15 ARG CG C 13 26.748 0.050 . . . . . . A 354 ARG CG . 34537 1 140 . 1 . 1 15 15 ARG CD C 13 42.953 0.096 . . . . . . A 354 ARG CD . 34537 1 141 . 1 . 1 15 15 ARG N N 15 122.032 0.009 . . . . . . A 354 ARG N . 34537 1 142 . 1 . 1 16 16 ILE H H 1 8.423 0.005 . . . . . . A 355 ILE H . 34537 1 143 . 1 . 1 16 16 ILE HA H 1 3.620 0.000 . . . . . . A 355 ILE HA . 34537 1 144 . 1 . 1 16 16 ILE HB H 1 1.797 0.000 . . . . . . A 355 ILE HB . 34537 1 145 . 1 . 1 16 16 ILE HG12 H 1 1.885 0.000 . . . . . . A 355 ILE HG12 . 34537 1 146 . 1 . 1 16 16 ILE HG13 H 1 1.048 0.000 . . . . . . A 355 ILE HG13 . 34537 1 147 . 1 . 1 16 16 ILE HG21 H 1 0.962 0.000 . . . . . . A 355 ILE HG21 . 34537 1 148 . 1 . 1 16 16 ILE HG22 H 1 0.962 0.000 . . . . . . A 355 ILE HG22 . 34537 1 149 . 1 . 1 16 16 ILE HG23 H 1 0.962 0.000 . . . . . . A 355 ILE HG23 . 34537 1 150 . 1 . 1 16 16 ILE HD11 H 1 0.734 0.000 . . . . . . A 355 ILE HD11 . 34537 1 151 . 1 . 1 16 16 ILE HD12 H 1 0.734 0.000 . . . . . . A 355 ILE HD12 . 34537 1 152 . 1 . 1 16 16 ILE HD13 H 1 0.734 0.000 . . . . . . A 355 ILE HD13 . 34537 1 153 . 1 . 1 16 16 ILE C C 13 177.699 0.000 . . . . . . A 355 ILE C . 34537 1 154 . 1 . 1 16 16 ILE CA C 13 65.850 0.020 . . . . . . A 355 ILE CA . 34537 1 155 . 1 . 1 16 16 ILE CB C 13 38.812 0.081 . . . . . . A 355 ILE CB . 34537 1 156 . 1 . 1 16 16 ILE CG1 C 13 30.258 0.009 . . . . . . A 355 ILE CG1 . 34537 1 157 . 1 . 1 16 16 ILE CG2 C 13 18.444 0.010 . . . . . . A 355 ILE CG2 . 34537 1 158 . 1 . 1 16 16 ILE CD1 C 13 15.355 0.019 . . . . . . A 355 ILE CD1 . 34537 1 159 . 1 . 1 16 16 ILE N N 15 120.777 0.018 . . . . . . A 355 ILE N . 34537 1 160 . 1 . 1 17 17 HIS H H 1 8.456 0.007 . . . . . . A 356 HIS H . 34537 1 161 . 1 . 1 17 17 HIS HA H 1 4.316 0.000 . . . . . . A 356 HIS HA . 34537 1 162 . 1 . 1 17 17 HIS HB2 H 1 3.247 0.000 . . . . . . A 356 HIS HB2 . 34537 1 163 . 1 . 1 17 17 HIS HB3 H 1 3.416 0.000 . . . . . . A 356 HIS HB3 . 34537 1 164 . 1 . 1 17 17 HIS HD2 H 1 6.847 0.000 . . . . . . A 356 HIS HD2 . 34537 1 165 . 1 . 1 17 17 HIS HE1 H 1 7.534 0.000 . . . . . . A 356 HIS HE1 . 34537 1 166 . 1 . 1 17 17 HIS C C 13 176.684 0.000 . . . . . . A 356 HIS C . 34537 1 167 . 1 . 1 17 17 HIS CA C 13 58.088 0.052 . . . . . . A 356 HIS CA . 34537 1 168 . 1 . 1 17 17 HIS CB C 13 29.906 0.050 . . . . . . A 356 HIS CB . 34537 1 169 . 1 . 1 17 17 HIS CD2 C 13 124.600 0.000 . . . . . . A 356 HIS CD2 . 34537 1 170 . 1 . 1 17 17 HIS CE1 C 13 137.837 0.000 . . . . . . A 356 HIS CE1 . 34537 1 171 . 1 . 1 17 17 HIS N N 15 117.921 0.033 . . . . . . A 356 HIS N . 34537 1 172 . 1 . 1 18 18 ALA H H 1 7.942 0.006 . . . . . . A 357 ALA H . 34537 1 173 . 1 . 1 18 18 ALA HA H 1 3.829 0.000 . . . . . . A 357 ALA HA . 34537 1 174 . 1 . 1 18 18 ALA HB1 H 1 1.507 0.000 . . . . . . A 357 ALA HB1 . 34537 1 175 . 1 . 1 18 18 ALA HB2 H 1 1.507 0.000 . . . . . . A 357 ALA HB2 . 34537 1 176 . 1 . 1 18 18 ALA HB3 H 1 1.507 0.000 . . . . . . A 357 ALA HB3 . 34537 1 177 . 1 . 1 18 18 ALA C C 13 179.761 0.000 . . . . . . A 357 ALA C . 34537 1 178 . 1 . 1 18 18 ALA CA C 13 55.539 0.053 . . . . . . A 357 ALA CA . 34537 1 179 . 1 . 1 18 18 ALA CB C 13 17.782 0.029 . . . . . . A 357 ALA CB . 34537 1 180 . 1 . 1 18 18 ALA N N 15 119.715 0.027 . . . . . . A 357 ALA N . 34537 1 181 . 1 . 1 19 19 GLU H H 1 8.431 0.001 . . . . . . A 358 GLU H . 34537 1 182 . 1 . 1 19 19 GLU HA H 1 3.983 0.000 . . . . . . A 358 GLU HA . 34537 1 183 . 1 . 1 19 19 GLU HB2 H 1 2.368 0.000 . . . . . . A 358 GLU HB2 . 34537 1 184 . 1 . 1 19 19 GLU HB3 H 1 1.970 0.000 . . . . . . A 358 GLU HB3 . 34537 1 185 . 1 . 1 19 19 GLU HG2 H 1 2.378 0.000 . . . . . . A 358 GLU HG2 . 34537 1 186 . 1 . 1 19 19 GLU HG3 H 1 2.378 0.000 . . . . . . A 358 GLU HG3 . 34537 1 187 . 1 . 1 19 19 GLU C C 13 179.944 0.000 . . . . . . A 358 GLU C . 34537 1 188 . 1 . 1 19 19 GLU CA C 13 59.340 0.058 . . . . . . A 358 GLU CA . 34537 1 189 . 1 . 1 19 19 GLU CB C 13 30.678 0.069 . . . . . . A 358 GLU CB . 34537 1 190 . 1 . 1 19 19 GLU CG C 13 36.652 0.043 . . . . . . A 358 GLU CG . 34537 1 191 . 1 . 1 19 19 GLU N N 15 118.560 0.020 . . . . . . A 358 GLU N . 34537 1 192 . 1 . 1 20 20 ILE H H 1 8.328 0.005 . . . . . . A 359 ILE H . 34537 1 193 . 1 . 1 20 20 ILE HA H 1 3.567 0.000 . . . . . . A 359 ILE HA . 34537 1 194 . 1 . 1 20 20 ILE HB H 1 2.023 0.000 . . . . . . A 359 ILE HB . 34537 1 195 . 1 . 1 20 20 ILE HG12 H 1 2.066 0.000 . . . . . . A 359 ILE HG12 . 34537 1 196 . 1 . 1 20 20 ILE HG13 H 1 0.917 0.000 . . . . . . A 359 ILE HG13 . 34537 1 197 . 1 . 1 20 20 ILE HG21 H 1 0.771 0.000 . . . . . . A 359 ILE HG21 . 34537 1 198 . 1 . 1 20 20 ILE HG22 H 1 0.771 0.000 . . . . . . A 359 ILE HG22 . 34537 1 199 . 1 . 1 20 20 ILE HG23 H 1 0.771 0.000 . . . . . . A 359 ILE HG23 . 34537 1 200 . 1 . 1 20 20 ILE HD11 H 1 0.757 0.000 . . . . . . A 359 ILE HD11 . 34537 1 201 . 1 . 1 20 20 ILE HD12 H 1 0.757 0.000 . . . . . . A 359 ILE HD12 . 34537 1 202 . 1 . 1 20 20 ILE HD13 H 1 0.757 0.000 . . . . . . A 359 ILE HD13 . 34537 1 203 . 1 . 1 20 20 ILE C C 13 177.473 0.000 . . . . . . A 359 ILE C . 34537 1 204 . 1 . 1 20 20 ILE CA C 13 66.339 0.058 . . . . . . A 359 ILE CA . 34537 1 205 . 1 . 1 20 20 ILE CB C 13 38.712 0.040 . . . . . . A 359 ILE CB . 34537 1 206 . 1 . 1 20 20 ILE CG1 C 13 29.251 0.042 . . . . . . A 359 ILE CG1 . 34537 1 207 . 1 . 1 20 20 ILE CG2 C 13 17.599 0.056 . . . . . . A 359 ILE CG2 . 34537 1 208 . 1 . 1 20 20 ILE CD1 C 13 14.381 0.029 . . . . . . A 359 ILE CD1 . 34537 1 209 . 1 . 1 20 20 ILE N N 15 120.665 0.027 . . . . . . A 359 ILE N . 34537 1 210 . 1 . 1 21 21 LYS H H 1 8.139 0.016 . . . . . . A 360 LYS H . 34537 1 211 . 1 . 1 21 21 LYS HA H 1 3.756 0.000 . . . . . . A 360 LYS HA . 34537 1 212 . 1 . 1 21 21 LYS HB2 H 1 1.674 0.000 . . . . . . A 360 LYS HB2 . 34537 1 213 . 1 . 1 21 21 LYS HB3 H 1 1.607 0.000 . . . . . . A 360 LYS HB3 . 34537 1 214 . 1 . 1 21 21 LYS HG2 H 1 1.415 0.000 . . . . . . A 360 LYS HG2 . 34537 1 215 . 1 . 1 21 21 LYS HG3 H 1 1.284 0.000 . . . . . . A 360 LYS HG3 . 34537 1 216 . 1 . 1 21 21 LYS HD2 H 1 1.431 0.000 . . . . . . A 360 LYS HD2 . 34537 1 217 . 1 . 1 21 21 LYS HD3 H 1 1.371 0.000 . . . . . . A 360 LYS HD3 . 34537 1 218 . 1 . 1 21 21 LYS HE2 H 1 2.647 0.000 . . . . . . A 360 LYS HE2 . 34537 1 219 . 1 . 1 21 21 LYS HE3 H 1 2.178 0.000 . . . . . . A 360 LYS HE3 . 34537 1 220 . 1 . 1 21 21 LYS C C 13 180.317 0.000 . . . . . . A 360 LYS C . 34537 1 221 . 1 . 1 21 21 LYS CA C 13 60.448 0.084 . . . . . . A 360 LYS CA . 34537 1 222 . 1 . 1 21 21 LYS CB C 13 32.232 0.045 . . . . . . A 360 LYS CB . 34537 1 223 . 1 . 1 21 21 LYS CG C 13 25.666 0.055 . . . . . . A 360 LYS CG . 34537 1 224 . 1 . 1 21 21 LYS CD C 13 29.260 0.016 . . . . . . A 360 LYS CD . 34537 1 225 . 1 . 1 21 21 LYS CE C 13 41.095 0.014 . . . . . . A 360 LYS CE . 34537 1 226 . 1 . 1 21 21 LYS N N 15 116.259 0.093 . . . . . . A 360 LYS N . 34537 1 227 . 1 . 1 22 22 ASN H H 1 8.759 0.006 . . . . . . A 361 ASN H . 34537 1 228 . 1 . 1 22 22 ASN HA H 1 4.423 0.000 . . . . . . A 361 ASN HA . 34537 1 229 . 1 . 1 22 22 ASN HB2 H 1 2.824 0.000 . . . . . . A 361 ASN HB2 . 34537 1 230 . 1 . 1 22 22 ASN HB3 H 1 2.738 0.000 . . . . . . A 361 ASN HB3 . 34537 1 231 . 1 . 1 22 22 ASN HD21 H 1 7.422 0.000 . . . . . . A 361 ASN HD21 . 34537 1 232 . 1 . 1 22 22 ASN HD22 H 1 6.999 0.000 . . . . . . A 361 ASN HD22 . 34537 1 233 . 1 . 1 22 22 ASN C C 13 177.790 0.000 . . . . . . A 361 ASN C . 34537 1 234 . 1 . 1 22 22 ASN CA C 13 55.769 0.043 . . . . . . A 361 ASN CA . 34537 1 235 . 1 . 1 22 22 ASN CB C 13 38.413 0.030 . . . . . . A 361 ASN CB . 34537 1 236 . 1 . 1 22 22 ASN N N 15 115.965 0.023 . . . . . . A 361 ASN N . 34537 1 237 . 1 . 1 22 22 ASN ND2 N 15 112.763 0.006 . . . . . . A 361 ASN ND2 . 34537 1 238 . 1 . 1 23 23 SER H H 1 7.906 0.002 . . . . . . A 362 SER H . 34537 1 239 . 1 . 1 23 23 SER HA H 1 4.340 0.000 . . . . . . A 362 SER HA . 34537 1 240 . 1 . 1 23 23 SER HB2 H 1 4.237 0.000 . . . . . . A 362 SER HB2 . 34537 1 241 . 1 . 1 23 23 SER HB3 H 1 3.999 0.000 . . . . . . A 362 SER HB3 . 34537 1 242 . 1 . 1 23 23 SER C C 13 173.459 0.000 . . . . . . A 362 SER C . 34537 1 243 . 1 . 1 23 23 SER CA C 13 61.623 0.014 . . . . . . A 362 SER CA . 34537 1 244 . 1 . 1 23 23 SER CB C 13 63.313 0.070 . . . . . . A 362 SER CB . 34537 1 245 . 1 . 1 23 23 SER N N 15 114.959 0.023 . . . . . . A 362 SER N . 34537 1 246 . 1 . 1 24 24 LEU H H 1 6.821 0.009 . . . . . . A 363 LEU H . 34537 1 247 . 1 . 1 24 24 LEU HA H 1 4.420 0.000 . . . . . . A 363 LEU HA . 34537 1 248 . 1 . 1 24 24 LEU HB2 H 1 1.492 0.000 . . . . . . A 363 LEU HB2 . 34537 1 249 . 1 . 1 24 24 LEU HB3 H 1 1.370 0.000 . . . . . . A 363 LEU HB3 . 34537 1 250 . 1 . 1 24 24 LEU HG H 1 1.817 0.000 . . . . . . A 363 LEU HG . 34537 1 251 . 1 . 1 24 24 LEU HD11 H 1 0.576 0.000 . . . . . . A 363 LEU HD11 . 34537 1 252 . 1 . 1 24 24 LEU HD12 H 1 0.576 0.000 . . . . . . A 363 LEU HD12 . 34537 1 253 . 1 . 1 24 24 LEU HD13 H 1 0.576 0.000 . . . . . . A 363 LEU HD13 . 34537 1 254 . 1 . 1 24 24 LEU HD21 H 1 0.462 0.000 . . . . . . A 363 LEU HD21 . 34537 1 255 . 1 . 1 24 24 LEU HD22 H 1 0.462 0.000 . . . . . . A 363 LEU HD22 . 34537 1 256 . 1 . 1 24 24 LEU HD23 H 1 0.462 0.000 . . . . . . A 363 LEU HD23 . 34537 1 257 . 1 . 1 24 24 LEU C C 13 176.454 0.000 . . . . . . A 363 LEU C . 34537 1 258 . 1 . 1 24 24 LEU CA C 13 53.793 0.081 . . . . . . A 363 LEU CA . 34537 1 259 . 1 . 1 24 24 LEU CB C 13 41.009 0.037 . . . . . . A 363 LEU CB . 34537 1 260 . 1 . 1 24 24 LEU CG C 13 25.674 0.000 . . . . . . A 363 LEU CG . 34537 1 261 . 1 . 1 24 24 LEU CD1 C 13 26.263 0.000 . . . . . . A 363 LEU CD1 . 34537 1 262 . 1 . 1 24 24 LEU CD2 C 13 21.835 0.000 . . . . . . A 363 LEU CD2 . 34537 1 263 . 1 . 1 24 24 LEU N N 15 118.523 0.108 . . . . . . A 363 LEU N . 34537 1 264 . 1 . 1 25 25 LYS H H 1 6.956 0.012 . . . . . . A 364 LYS H . 34537 1 265 . 1 . 1 25 25 LYS HA H 1 4.244 0.000 . . . . . . A 364 LYS HA . 34537 1 266 . 1 . 1 25 25 LYS HB2 H 1 1.899 0.000 . . . . . . A 364 LYS HB2 . 34537 1 267 . 1 . 1 25 25 LYS HB3 H 1 1.751 0.000 . . . . . . A 364 LYS HB3 . 34537 1 268 . 1 . 1 25 25 LYS HG2 H 1 1.703 0.000 . . . . . . A 364 LYS HG2 . 34537 1 269 . 1 . 1 25 25 LYS HG3 H 1 1.508 0.000 . . . . . . A 364 LYS HG3 . 34537 1 270 . 1 . 1 25 25 LYS HD2 H 1 1.788 0.000 . . . . . . A 364 LYS HD2 . 34537 1 271 . 1 . 1 25 25 LYS HD3 H 1 1.788 0.000 . . . . . . A 364 LYS HD3 . 34537 1 272 . 1 . 1 25 25 LYS HE2 H 1 3.057 0.000 . . . . . . A 364 LYS HE2 . 34537 1 273 . 1 . 1 25 25 LYS HE3 H 1 3.057 0.000 . . . . . . A 364 LYS HE3 . 34537 1 274 . 1 . 1 25 25 LYS C C 13 178.433 0.000 . . . . . . A 364 LYS C . 34537 1 275 . 1 . 1 25 25 LYS CA C 13 56.650 0.068 . . . . . . A 364 LYS CA . 34537 1 276 . 1 . 1 25 25 LYS CB C 13 33.124 0.070 . . . . . . A 364 LYS CB . 34537 1 277 . 1 . 1 25 25 LYS CG C 13 25.177 0.007 . . . . . . A 364 LYS CG . 34537 1 278 . 1 . 1 25 25 LYS CD C 13 29.471 0.000 . . . . . . A 364 LYS CD . 34537 1 279 . 1 . 1 25 25 LYS CE C 13 42.257 0.000 . . . . . . A 364 LYS CE . 34537 1 280 . 1 . 1 25 25 LYS N N 15 121.549 0.067 . . . . . . A 364 LYS N . 34537 1 281 . 1 . 1 26 26 ILE H H 1 8.255 0.003 . . . . . . A 365 ILE H . 34537 1 282 . 1 . 1 26 26 ILE HA H 1 3.884 0.000 . . . . . . A 365 ILE HA . 34537 1 283 . 1 . 1 26 26 ILE HB H 1 1.944 0.000 . . . . . . A 365 ILE HB . 34537 1 284 . 1 . 1 26 26 ILE HG12 H 1 1.551 0.000 . . . . . . A 365 ILE HG12 . 34537 1 285 . 1 . 1 26 26 ILE HG13 H 1 1.376 0.000 . . . . . . A 365 ILE HG13 . 34537 1 286 . 1 . 1 26 26 ILE HG21 H 1 0.999 0.000 . . . . . . A 365 ILE HG21 . 34537 1 287 . 1 . 1 26 26 ILE HG22 H 1 0.999 0.000 . . . . . . A 365 ILE HG22 . 34537 1 288 . 1 . 1 26 26 ILE HG23 H 1 0.999 0.000 . . . . . . A 365 ILE HG23 . 34537 1 289 . 1 . 1 26 26 ILE HD11 H 1 0.960 0.000 . . . . . . A 365 ILE HD11 . 34537 1 290 . 1 . 1 26 26 ILE HD12 H 1 0.960 0.000 . . . . . . A 365 ILE HD12 . 34537 1 291 . 1 . 1 26 26 ILE HD13 H 1 0.960 0.000 . . . . . . A 365 ILE HD13 . 34537 1 292 . 1 . 1 26 26 ILE C C 13 176.600 0.000 . . . . . . A 365 ILE C . 34537 1 293 . 1 . 1 26 26 ILE CA C 13 63.600 0.022 . . . . . . A 365 ILE CA . 34537 1 294 . 1 . 1 26 26 ILE CB C 13 38.159 0.065 . . . . . . A 365 ILE CB . 34537 1 295 . 1 . 1 26 26 ILE CG1 C 13 28.150 0.015 . . . . . . A 365 ILE CG1 . 34537 1 296 . 1 . 1 26 26 ILE CG2 C 13 17.672 0.012 . . . . . . A 365 ILE CG2 . 34537 1 297 . 1 . 1 26 26 ILE CD1 C 13 13.315 0.000 . . . . . . A 365 ILE CD1 . 34537 1 298 . 1 . 1 26 26 ILE N N 15 122.591 0.012 . . . . . . A 365 ILE N . 34537 1 299 . 1 . 1 27 27 ASP H H 1 8.413 0.006 . . . . . . A 366 ASP H . 34537 1 300 . 1 . 1 27 27 ASP HA H 1 4.530 0.000 . . . . . . A 366 ASP HA . 34537 1 301 . 1 . 1 27 27 ASP HB2 H 1 2.757 0.000 . . . . . . A 366 ASP HB2 . 34537 1 302 . 1 . 1 27 27 ASP HB3 H 1 2.687 0.000 . . . . . . A 366 ASP HB3 . 34537 1 303 . 1 . 1 27 27 ASP C C 13 175.866 0.000 . . . . . . A 366 ASP C . 34537 1 304 . 1 . 1 27 27 ASP CA C 13 54.520 0.003 . . . . . . A 366 ASP CA . 34537 1 305 . 1 . 1 27 27 ASP CB C 13 40.282 0.042 . . . . . . A 366 ASP CB . 34537 1 306 . 1 . 1 27 27 ASP N N 15 117.889 0.062 . . . . . . A 366 ASP N . 34537 1 307 . 1 . 1 28 28 ASN H H 1 7.828 0.003 . . . . . . A 367 ASN H . 34537 1 308 . 1 . 1 28 28 ASN HA H 1 4.798 0.000 . . . . . . A 367 ASN HA . 34537 1 309 . 1 . 1 28 28 ASN HB2 H 1 2.759 0.000 . . . . . . A 367 ASN HB2 . 34537 1 310 . 1 . 1 28 28 ASN HB3 H 1 2.496 0.000 . . . . . . A 367 ASN HB3 . 34537 1 311 . 1 . 1 28 28 ASN HD21 H 1 7.415 0.000 . . . . . . A 367 ASN HD21 . 34537 1 312 . 1 . 1 28 28 ASN HD22 H 1 6.869 0.000 . . . . . . A 367 ASN HD22 . 34537 1 313 . 1 . 1 28 28 ASN C C 13 173.034 0.000 . . . . . . A 367 ASN C . 34537 1 314 . 1 . 1 28 28 ASN CA C 13 52.962 0.001 . . . . . . A 367 ASN CA . 34537 1 315 . 1 . 1 28 28 ASN CB C 13 39.538 0.023 . . . . . . A 367 ASN CB . 34537 1 316 . 1 . 1 28 28 ASN N N 15 118.865 0.010 . . . . . . A 367 ASN N . 34537 1 317 . 1 . 1 28 28 ASN ND2 N 15 112.209 0.023 . . . . . . A 367 ASN ND2 . 34537 1 318 . 1 . 1 29 29 LEU H H 1 7.893 0.003 . . . . . . A 368 LEU H . 34537 1 319 . 1 . 1 29 29 LEU HA H 1 4.283 0.000 . . . . . . A 368 LEU HA . 34537 1 320 . 1 . 1 29 29 LEU HB2 H 1 1.646 0.000 . . . . . . A 368 LEU HB2 . 34537 1 321 . 1 . 1 29 29 LEU HB3 H 1 1.646 0.000 . . . . . . A 368 LEU HB3 . 34537 1 322 . 1 . 1 29 29 LEU HG H 1 1.661 0.000 . . . . . . A 368 LEU HG . 34537 1 323 . 1 . 1 29 29 LEU HD11 H 1 1.009 0.000 . . . . . . A 368 LEU HD11 . 34537 1 324 . 1 . 1 29 29 LEU HD12 H 1 1.009 0.000 . . . . . . A 368 LEU HD12 . 34537 1 325 . 1 . 1 29 29 LEU HD13 H 1 1.009 0.000 . . . . . . A 368 LEU HD13 . 34537 1 326 . 1 . 1 29 29 LEU HD21 H 1 0.936 0.003 . . . . . . A 368 LEU HD21 . 34537 1 327 . 1 . 1 29 29 LEU HD22 H 1 0.936 0.003 . . . . . . A 368 LEU HD22 . 34537 1 328 . 1 . 1 29 29 LEU HD23 H 1 0.936 0.003 . . . . . . A 368 LEU HD23 . 34537 1 329 . 1 . 1 29 29 LEU C C 13 177.426 0.000 . . . . . . A 368 LEU C . 34537 1 330 . 1 . 1 29 29 LEU CA C 13 56.475 0.145 . . . . . . A 368 LEU CA . 34537 1 331 . 1 . 1 29 29 LEU CB C 13 42.722 0.074 . . . . . . A 368 LEU CB . 34537 1 332 . 1 . 1 29 29 LEU CG C 13 27.226 0.000 . . . . . . A 368 LEU CG . 34537 1 333 . 1 . 1 29 29 LEU CD1 C 13 24.947 0.000 . . . . . . A 368 LEU CD1 . 34537 1 334 . 1 . 1 29 29 LEU CD2 C 13 25.676 0.029 . . . . . . A 368 LEU CD2 . 34537 1 335 . 1 . 1 29 29 LEU N N 15 123.421 0.002 . . . . . . A 368 LEU N . 34537 1 336 . 1 . 1 30 30 ASP H H 1 9.267 0.017 . . . . . . A 369 ASP H . 34537 1 337 . 1 . 1 30 30 ASP HA H 1 4.871 0.000 . . . . . . A 369 ASP HA . 34537 1 338 . 1 . 1 30 30 ASP HB2 H 1 2.997 0.000 . . . . . . A 369 ASP HB2 . 34537 1 339 . 1 . 1 30 30 ASP HB3 H 1 2.483 0.000 . . . . . . A 369 ASP HB3 . 34537 1 340 . 1 . 1 30 30 ASP C C 13 175.552 0.000 . . . . . . A 369 ASP C . 34537 1 341 . 1 . 1 30 30 ASP CA C 13 52.462 0.081 . . . . . . A 369 ASP CA . 34537 1 342 . 1 . 1 30 30 ASP CB C 13 40.994 0.018 . . . . . . A 369 ASP CB . 34537 1 343 . 1 . 1 30 30 ASP N N 15 127.487 0.057 . . . . . . A 369 ASP N . 34537 1 344 . 1 . 1 31 31 VAL H H 1 8.436 0.012 . . . . . . A 370 VAL H . 34537 1 345 . 1 . 1 31 31 VAL HA H 1 3.512 0.000 . . . . . . A 370 VAL HA . 34537 1 346 . 1 . 1 31 31 VAL HB H 1 2.123 0.000 . . . . . . A 370 VAL HB . 34537 1 347 . 1 . 1 31 31 VAL HG11 H 1 1.117 0.000 . . . . . . A 370 VAL HG11 . 34537 1 348 . 1 . 1 31 31 VAL HG12 H 1 1.117 0.000 . . . . . . A 370 VAL HG12 . 34537 1 349 . 1 . 1 31 31 VAL HG13 H 1 1.117 0.000 . . . . . . A 370 VAL HG13 . 34537 1 350 . 1 . 1 31 31 VAL HG21 H 1 1.073 0.000 . . . . . . A 370 VAL HG21 . 34537 1 351 . 1 . 1 31 31 VAL HG22 H 1 1.073 0.000 . . . . . . A 370 VAL HG22 . 34537 1 352 . 1 . 1 31 31 VAL HG23 H 1 1.073 0.000 . . . . . . A 370 VAL HG23 . 34537 1 353 . 1 . 1 31 31 VAL C C 13 177.718 0.000 . . . . . . A 370 VAL C . 34537 1 354 . 1 . 1 31 31 VAL CA C 13 66.582 0.047 . . . . . . A 370 VAL CA . 34537 1 355 . 1 . 1 31 31 VAL CB C 13 32.146 0.044 . . . . . . A 370 VAL CB . 34537 1 356 . 1 . 1 31 31 VAL CG1 C 13 21.620 0.017 . . . . . . A 370 VAL CG1 . 34537 1 357 . 1 . 1 31 31 VAL CG2 C 13 21.611 0.000 . . . . . . A 370 VAL CG2 . 34537 1 358 . 1 . 1 31 31 VAL N N 15 122.735 0.026 . . . . . . A 370 VAL N . 34537 1 359 . 1 . 1 32 32 ASN H H 1 8.483 0.002 . . . . . . A 371 ASN H . 34537 1 360 . 1 . 1 32 32 ASN HA H 1 4.434 0.000 . . . . . . A 371 ASN HA . 34537 1 361 . 1 . 1 32 32 ASN HB2 H 1 2.889 0.000 . . . . . . A 371 ASN HB2 . 34537 1 362 . 1 . 1 32 32 ASN HB3 H 1 2.821 0.000 . . . . . . A 371 ASN HB3 . 34537 1 363 . 1 . 1 32 32 ASN HD21 H 1 7.784 0.000 . . . . . . A 371 ASN HD21 . 34537 1 364 . 1 . 1 32 32 ASN HD22 H 1 6.940 0.000 . . . . . . A 371 ASN HD22 . 34537 1 365 . 1 . 1 32 32 ASN C C 13 177.595 0.000 . . . . . . A 371 ASN C . 34537 1 366 . 1 . 1 32 32 ASN CA C 13 56.815 0.099 . . . . . . A 371 ASN CA . 34537 1 367 . 1 . 1 32 32 ASN CB C 13 37.765 0.048 . . . . . . A 371 ASN CB . 34537 1 368 . 1 . 1 32 32 ASN N N 15 117.613 0.017 . . . . . . A 371 ASN N . 34537 1 369 . 1 . 1 32 32 ASN ND2 N 15 113.235 0.005 . . . . . . A 371 ASN ND2 . 34537 1 370 . 1 . 1 33 33 ARG H H 1 7.700 0.002 . . . . . . A 372 ARG H . 34537 1 371 . 1 . 1 33 33 ARG HA H 1 4.076 0.001 . . . . . . A 372 ARG HA . 34537 1 372 . 1 . 1 33 33 ARG HB2 H 1 1.799 0.000 . . . . . . A 372 ARG HB2 . 34537 1 373 . 1 . 1 33 33 ARG HB3 H 1 1.799 0.000 . . . . . . A 372 ARG HB3 . 34537 1 374 . 1 . 1 33 33 ARG HG2 H 1 1.740 0.000 . . . . . . A 372 ARG HG2 . 34537 1 375 . 1 . 1 33 33 ARG HG3 H 1 1.531 0.000 . . . . . . A 372 ARG HG3 . 34537 1 376 . 1 . 1 33 33 ARG HD2 H 1 3.197 0.000 . . . . . . A 372 ARG HD2 . 34537 1 377 . 1 . 1 33 33 ARG HD3 H 1 3.067 0.000 . . . . . . A 372 ARG HD3 . 34537 1 378 . 1 . 1 33 33 ARG HE H 1 7.875 0.000 . . . . . . A 372 ARG HE . 34537 1 379 . 1 . 1 33 33 ARG CA C 13 58.696 0.090 . . . . . . A 372 ARG CA . 34537 1 380 . 1 . 1 33 33 ARG CB C 13 30.672 0.059 . . . . . . A 372 ARG CB . 34537 1 381 . 1 . 1 33 33 ARG CG C 13 27.186 0.080 . . . . . . A 372 ARG CG . 34537 1 382 . 1 . 1 33 33 ARG CD C 13 44.113 0.074 . . . . . . A 372 ARG CD . 34537 1 383 . 1 . 1 33 33 ARG N N 15 121.695 0.050 . . . . . . A 372 ARG N . 34537 1 384 . 1 . 1 33 33 ARG NE N 15 85.562 0.000 . . . . . . A 372 ARG NE . 34537 1 385 . 1 . 1 34 34 CYS H H 1 7.819 0.012 . . . . . . A 373 CYS H . 34537 1 386 . 1 . 1 34 34 CYS HA H 1 3.883 0.000 . . . . . . A 373 CYS HA . 34537 1 387 . 1 . 1 34 34 CYS HB2 H 1 3.150 0.000 . . . . . . A 373 CYS HB2 . 34537 1 388 . 1 . 1 34 34 CYS HB3 H 1 3.040 0.006 . . . . . . A 373 CYS HB3 . 34537 1 389 . 1 . 1 34 34 CYS HG H 1 1.465 0.000 . . . . . . A 373 CYS HG . 34537 1 390 . 1 . 1 34 34 CYS C C 13 176.778 0.000 . . . . . . A 373 CYS C . 34537 1 391 . 1 . 1 34 34 CYS CA C 13 63.493 0.011 . . . . . . A 373 CYS CA . 34537 1 392 . 1 . 1 34 34 CYS CB C 13 26.829 0.031 . . . . . . A 373 CYS CB . 34537 1 393 . 1 . 1 34 34 CYS N N 15 120.234 0.039 . . . . . . A 373 CYS N . 34537 1 394 . 1 . 1 35 35 ILE H H 1 8.462 0.002 . . . . . . A 374 ILE H . 34537 1 395 . 1 . 1 35 35 ILE HA H 1 3.398 0.000 . . . . . . A 374 ILE HA . 34537 1 396 . 1 . 1 35 35 ILE HB H 1 1.931 0.000 . . . . . . A 374 ILE HB . 34537 1 397 . 1 . 1 35 35 ILE HG12 H 1 0.708 0.000 . . . . . . A 374 ILE HG12 . 34537 1 398 . 1 . 1 35 35 ILE HG13 H 1 1.899 0.000 . . . . . . A 374 ILE HG13 . 34537 1 399 . 1 . 1 35 35 ILE HG21 H 1 0.882 0.000 . . . . . . A 374 ILE HG21 . 34537 1 400 . 1 . 1 35 35 ILE HG22 H 1 0.882 0.000 . . . . . . A 374 ILE HG22 . 34537 1 401 . 1 . 1 35 35 ILE HG23 H 1 0.882 0.000 . . . . . . A 374 ILE HG23 . 34537 1 402 . 1 . 1 35 35 ILE HD11 H 1 0.888 0.000 . . . . . . A 374 ILE HD11 . 34537 1 403 . 1 . 1 35 35 ILE HD12 H 1 0.888 0.000 . . . . . . A 374 ILE HD12 . 34537 1 404 . 1 . 1 35 35 ILE HD13 H 1 0.888 0.000 . . . . . . A 374 ILE HD13 . 34537 1 405 . 1 . 1 35 35 ILE C C 13 176.985 0.000 . . . . . . A 374 ILE C . 34537 1 406 . 1 . 1 35 35 ILE CA C 13 66.717 0.019 . . . . . . A 374 ILE CA . 34537 1 407 . 1 . 1 35 35 ILE CB C 13 37.974 0.016 . . . . . . A 374 ILE CB . 34537 1 408 . 1 . 1 35 35 ILE CG1 C 13 31.216 0.034 . . . . . . A 374 ILE CG1 . 34537 1 409 . 1 . 1 35 35 ILE CG2 C 13 17.720 0.021 . . . . . . A 374 ILE CG2 . 34537 1 410 . 1 . 1 35 35 ILE CD1 C 13 14.286 0.000 . . . . . . A 374 ILE CD1 . 34537 1 411 . 1 . 1 35 35 ILE N N 15 118.949 0.028 . . . . . . A 374 ILE N . 34537 1 412 . 1 . 1 36 36 GLU H H 1 8.021 0.005 . . . . . . A 375 GLU H . 34537 1 413 . 1 . 1 36 36 GLU HA H 1 4.079 0.000 . . . . . . A 375 GLU HA . 34537 1 414 . 1 . 1 36 36 GLU HB2 H 1 2.118 0.000 . . . . . . A 375 GLU HB2 . 34537 1 415 . 1 . 1 36 36 GLU HB3 H 1 2.047 0.000 . . . . . . A 375 GLU HB3 . 34537 1 416 . 1 . 1 36 36 GLU HG2 H 1 2.498 0.000 . . . . . . A 375 GLU HG2 . 34537 1 417 . 1 . 1 36 36 GLU HG3 H 1 2.300 0.000 . . . . . . A 375 GLU HG3 . 34537 1 418 . 1 . 1 36 36 GLU C C 13 179.837 0.000 . . . . . . A 375 GLU C . 34537 1 419 . 1 . 1 36 36 GLU CA C 13 59.976 0.066 . . . . . . A 375 GLU CA . 34537 1 420 . 1 . 1 36 36 GLU CB C 13 29.460 0.052 . . . . . . A 375 GLU CB . 34537 1 421 . 1 . 1 36 36 GLU CG C 13 36.648 0.064 . . . . . . A 375 GLU CG . 34537 1 422 . 1 . 1 36 36 GLU N N 15 118.201 0.023 . . . . . . A 375 GLU N . 34537 1 423 . 1 . 1 37 37 ALA H H 1 7.605 0.003 . . . . . . A 376 ALA H . 34537 1 424 . 1 . 1 37 37 ALA HA H 1 4.396 0.000 . . . . . . A 376 ALA HA . 34537 1 425 . 1 . 1 37 37 ALA HB1 H 1 1.590 0.000 . . . . . . A 376 ALA HB1 . 34537 1 426 . 1 . 1 37 37 ALA HB2 H 1 1.590 0.000 . . . . . . A 376 ALA HB2 . 34537 1 427 . 1 . 1 37 37 ALA HB3 H 1 1.590 0.000 . . . . . . A 376 ALA HB3 . 34537 1 428 . 1 . 1 37 37 ALA C C 13 179.489 0.000 . . . . . . A 376 ALA C . 34537 1 429 . 1 . 1 37 37 ALA CA C 13 55.417 0.043 . . . . . . A 376 ALA CA . 34537 1 430 . 1 . 1 37 37 ALA CB C 13 18.655 0.045 . . . . . . A 376 ALA CB . 34537 1 431 . 1 . 1 37 37 ALA N N 15 122.971 0.028 . . . . . . A 376 ALA N . 34537 1 432 . 1 . 1 38 38 LEU H H 1 8.497 0.003 . . . . . . A 377 LEU H . 34537 1 433 . 1 . 1 38 38 LEU HA H 1 3.912 0.000 . . . . . . A 377 LEU HA . 34537 1 434 . 1 . 1 38 38 LEU HB2 H 1 2.050 0.000 . . . . . . A 377 LEU HB2 . 34537 1 435 . 1 . 1 38 38 LEU HB3 H 1 1.223 0.000 . . . . . . A 377 LEU HB3 . 34537 1 436 . 1 . 1 38 38 LEU HG H 1 2.083 0.000 . . . . . . A 377 LEU HG . 34537 1 437 . 1 . 1 38 38 LEU HD11 H 1 0.866 0.003 . . . . . . A 377 LEU HD11 . 34537 1 438 . 1 . 1 38 38 LEU HD12 H 1 0.866 0.003 . . . . . . A 377 LEU HD12 . 34537 1 439 . 1 . 1 38 38 LEU HD13 H 1 0.866 0.003 . . . . . . A 377 LEU HD13 . 34537 1 440 . 1 . 1 38 38 LEU HD21 H 1 0.681 0.000 . . . . . . A 377 LEU HD21 . 34537 1 441 . 1 . 1 38 38 LEU HD22 H 1 0.681 0.000 . . . . . . A 377 LEU HD22 . 34537 1 442 . 1 . 1 38 38 LEU HD23 H 1 0.681 0.000 . . . . . . A 377 LEU HD23 . 34537 1 443 . 1 . 1 38 38 LEU C C 13 179.861 0.000 . . . . . . A 377 LEU C . 34537 1 444 . 1 . 1 38 38 LEU CA C 13 58.008 0.105 . . . . . . A 377 LEU CA . 34537 1 445 . 1 . 1 38 38 LEU CB C 13 41.280 0.053 . . . . . . A 377 LEU CB . 34537 1 446 . 1 . 1 38 38 LEU CG C 13 26.428 0.000 . . . . . . A 377 LEU CG . 34537 1 447 . 1 . 1 38 38 LEU CD1 C 13 28.052 0.006 . . . . . . A 377 LEU CD1 . 34537 1 448 . 1 . 1 38 38 LEU CD2 C 13 23.281 0.000 . . . . . . A 377 LEU CD2 . 34537 1 449 . 1 . 1 38 38 LEU N N 15 118.443 0.028 . . . . . . A 377 LEU N . 34537 1 450 . 1 . 1 39 39 ASP H H 1 8.990 0.003 . . . . . . A 378 ASP H . 34537 1 451 . 1 . 1 39 39 ASP HA H 1 4.454 0.000 . . . . . . A 378 ASP HA . 34537 1 452 . 1 . 1 39 39 ASP HB2 H 1 2.759 0.000 . . . . . . A 378 ASP HB2 . 34537 1 453 . 1 . 1 39 39 ASP HB3 H 1 2.551 0.000 . . . . . . A 378 ASP HB3 . 34537 1 454 . 1 . 1 39 39 ASP C C 13 179.561 0.000 . . . . . . A 378 ASP C . 34537 1 455 . 1 . 1 39 39 ASP CA C 13 57.347 0.016 . . . . . . A 378 ASP CA . 34537 1 456 . 1 . 1 39 39 ASP CB C 13 39.380 0.044 . . . . . . A 378 ASP CB . 34537 1 457 . 1 . 1 39 39 ASP N N 15 121.341 0.019 . . . . . . A 378 ASP N . 34537 1 458 . 1 . 1 40 40 GLU H H 1 8.167 0.003 . . . . . . A 379 GLU H . 34537 1 459 . 1 . 1 40 40 GLU HA H 1 4.005 0.000 . . . . . . A 379 GLU HA . 34537 1 460 . 1 . 1 40 40 GLU HB2 H 1 2.160 0.000 . . . . . . A 379 GLU HB2 . 34537 1 461 . 1 . 1 40 40 GLU HB3 H 1 2.160 0.000 . . . . . . A 379 GLU HB3 . 34537 1 462 . 1 . 1 40 40 GLU HG2 H 1 2.369 0.000 . . . . . . A 379 GLU HG2 . 34537 1 463 . 1 . 1 40 40 GLU HG3 H 1 2.080 0.000 . . . . . . A 379 GLU HG3 . 34537 1 464 . 1 . 1 40 40 GLU C C 13 180.491 0.000 . . . . . . A 379 GLU C . 34537 1 465 . 1 . 1 40 40 GLU CA C 13 59.833 0.049 . . . . . . A 379 GLU CA . 34537 1 466 . 1 . 1 40 40 GLU CB C 13 28.712 0.007 . . . . . . A 379 GLU CB . 34537 1 467 . 1 . 1 40 40 GLU CG C 13 36.291 0.050 . . . . . . A 379 GLU CG . 34537 1 468 . 1 . 1 40 40 GLU N N 15 123.542 0.030 . . . . . . A 379 GLU N . 34537 1 469 . 1 . 1 41 41 LEU H H 1 8.562 0.001 . . . . . . A 380 LEU H . 34537 1 470 . 1 . 1 41 41 LEU HA H 1 4.010 0.000 . . . . . . A 380 LEU HA . 34537 1 471 . 1 . 1 41 41 LEU HB2 H 1 1.729 0.000 . . . . . . A 380 LEU HB2 . 34537 1 472 . 1 . 1 41 41 LEU HB3 H 1 2.258 0.000 . . . . . . A 380 LEU HB3 . 34537 1 473 . 1 . 1 41 41 LEU HG H 1 1.777 0.000 . . . . . . A 380 LEU HG . 34537 1 474 . 1 . 1 41 41 LEU HD11 H 1 1.010 0.000 . . . . . . A 380 LEU HD11 . 34537 1 475 . 1 . 1 41 41 LEU HD12 H 1 1.010 0.000 . . . . . . A 380 LEU HD12 . 34537 1 476 . 1 . 1 41 41 LEU HD13 H 1 1.010 0.000 . . . . . . A 380 LEU HD13 . 34537 1 477 . 1 . 1 41 41 LEU HD21 H 1 1.002 0.000 . . . . . . A 380 LEU HD21 . 34537 1 478 . 1 . 1 41 41 LEU HD22 H 1 1.002 0.000 . . . . . . A 380 LEU HD22 . 34537 1 479 . 1 . 1 41 41 LEU HD23 H 1 1.002 0.000 . . . . . . A 380 LEU HD23 . 34537 1 480 . 1 . 1 41 41 LEU C C 13 178.747 0.000 . . . . . . A 380 LEU C . 34537 1 481 . 1 . 1 41 41 LEU CA C 13 58.045 0.087 . . . . . . A 380 LEU CA . 34537 1 482 . 1 . 1 41 41 LEU CB C 13 41.206 0.063 . . . . . . A 380 LEU CB . 34537 1 483 . 1 . 1 41 41 LEU CG C 13 26.977 0.164 . . . . . . A 380 LEU CG . 34537 1 484 . 1 . 1 41 41 LEU CD1 C 13 26.420 0.000 . . . . . . A 380 LEU CD1 . 34537 1 485 . 1 . 1 41 41 LEU CD2 C 13 23.389 0.000 . . . . . . A 380 LEU CD2 . 34537 1 486 . 1 . 1 41 41 LEU N N 15 121.459 0.018 . . . . . . A 380 LEU N . 34537 1 487 . 1 . 1 42 42 ALA H H 1 8.374 0.004 . . . . . . A 381 ALA H . 34537 1 488 . 1 . 1 42 42 ALA HA H 1 4.024 0.000 . . . . . . A 381 ALA HA . 34537 1 489 . 1 . 1 42 42 ALA HB1 H 1 1.591 0.000 . . . . . . A 381 ALA HB1 . 34537 1 490 . 1 . 1 42 42 ALA HB2 H 1 1.591 0.000 . . . . . . A 381 ALA HB2 . 34537 1 491 . 1 . 1 42 42 ALA HB3 H 1 1.591 0.000 . . . . . . A 381 ALA HB3 . 34537 1 492 . 1 . 1 42 42 ALA C C 13 177.855 0.000 . . . . . . A 381 ALA C . 34537 1 493 . 1 . 1 42 42 ALA CA C 13 54.418 0.038 . . . . . . A 381 ALA CA . 34537 1 494 . 1 . 1 42 42 ALA CB C 13 18.788 0.019 . . . . . . A 381 ALA CB . 34537 1 495 . 1 . 1 42 42 ALA N N 15 118.932 0.028 . . . . . . A 381 ALA N . 34537 1 496 . 1 . 1 43 43 SER H H 1 7.592 0.005 . . . . . . A 382 SER H . 34537 1 497 . 1 . 1 43 43 SER HA H 1 4.442 0.000 . . . . . . A 382 SER HA . 34537 1 498 . 1 . 1 43 43 SER HB2 H 1 4.070 0.000 . . . . . . A 382 SER HB2 . 34537 1 499 . 1 . 1 43 43 SER HB3 H 1 3.981 0.000 . . . . . . A 382 SER HB3 . 34537 1 500 . 1 . 1 43 43 SER C C 13 174.270 0.000 . . . . . . A 382 SER C . 34537 1 501 . 1 . 1 43 43 SER CA C 13 59.434 0.019 . . . . . . A 382 SER CA . 34537 1 502 . 1 . 1 43 43 SER CB C 13 64.558 0.040 . . . . . . A 382 SER CB . 34537 1 503 . 1 . 1 43 43 SER N N 15 112.138 0.014 . . . . . . A 382 SER N . 34537 1 504 . 1 . 1 44 44 LEU H H 1 7.295 0.004 . . . . . . A 383 LEU H . 34537 1 505 . 1 . 1 44 44 LEU HA H 1 4.380 0.000 . . . . . . A 383 LEU HA . 34537 1 506 . 1 . 1 44 44 LEU HB2 H 1 1.857 0.010 . . . . . . A 383 LEU HB2 . 34537 1 507 . 1 . 1 44 44 LEU HB3 H 1 1.324 0.000 . . . . . . A 383 LEU HB3 . 34537 1 508 . 1 . 1 44 44 LEU HG H 1 2.064 0.000 . . . . . . A 383 LEU HG . 34537 1 509 . 1 . 1 44 44 LEU HD11 H 1 0.785 0.000 . . . . . . A 383 LEU HD11 . 34537 1 510 . 1 . 1 44 44 LEU HD12 H 1 0.785 0.000 . . . . . . A 383 LEU HD12 . 34537 1 511 . 1 . 1 44 44 LEU HD13 H 1 0.785 0.000 . . . . . . A 383 LEU HD13 . 34537 1 512 . 1 . 1 44 44 LEU HD21 H 1 0.774 0.000 . . . . . . A 383 LEU HD21 . 34537 1 513 . 1 . 1 44 44 LEU HD22 H 1 0.774 0.000 . . . . . . A 383 LEU HD22 . 34537 1 514 . 1 . 1 44 44 LEU HD23 H 1 0.774 0.000 . . . . . . A 383 LEU HD23 . 34537 1 515 . 1 . 1 44 44 LEU C C 13 177.110 0.000 . . . . . . A 383 LEU C . 34537 1 516 . 1 . 1 44 44 LEU CA C 13 54.701 0.115 . . . . . . A 383 LEU CA . 34537 1 517 . 1 . 1 44 44 LEU CB C 13 43.252 0.067 . . . . . . A 383 LEU CB . 34537 1 518 . 1 . 1 44 44 LEU CG C 13 25.857 0.015 . . . . . . A 383 LEU CG . 34537 1 519 . 1 . 1 44 44 LEU CD1 C 13 25.936 0.000 . . . . . . A 383 LEU CD1 . 34537 1 520 . 1 . 1 44 44 LEU CD2 C 13 22.432 0.034 . . . . . . A 383 LEU CD2 . 34537 1 521 . 1 . 1 44 44 LEU N N 15 122.216 0.011 . . . . . . A 383 LEU N . 34537 1 522 . 1 . 1 45 45 GLN H H 1 8.674 0.005 . . . . . . A 384 GLN H . 34537 1 523 . 1 . 1 45 45 GLN HA H 1 4.468 0.000 . . . . . . A 384 GLN HA . 34537 1 524 . 1 . 1 45 45 GLN HB2 H 1 2.054 0.000 . . . . . . A 384 GLN HB2 . 34537 1 525 . 1 . 1 45 45 GLN HB3 H 1 1.997 0.000 . . . . . . A 384 GLN HB3 . 34537 1 526 . 1 . 1 45 45 GLN HG2 H 1 2.357 0.000 . . . . . . A 384 GLN HG2 . 34537 1 527 . 1 . 1 45 45 GLN HG3 H 1 2.318 0.000 . . . . . . A 384 GLN HG3 . 34537 1 528 . 1 . 1 45 45 GLN C C 13 174.461 0.000 . . . . . . A 384 GLN C . 34537 1 529 . 1 . 1 45 45 GLN CA C 13 54.991 0.106 . . . . . . A 384 GLN CA . 34537 1 530 . 1 . 1 45 45 GLN CB C 13 27.427 0.006 . . . . . . A 384 GLN CB . 34537 1 531 . 1 . 1 45 45 GLN CG C 13 33.726 0.007 . . . . . . A 384 GLN CG . 34537 1 532 . 1 . 1 45 45 GLN N N 15 123.840 0.068 . . . . . . A 384 GLN N . 34537 1 533 . 1 . 1 46 46 VAL H H 1 7.826 0.006 . . . . . . A 385 VAL H . 34537 1 534 . 1 . 1 46 46 VAL HA H 1 4.421 0.000 . . . . . . A 385 VAL HA . 34537 1 535 . 1 . 1 46 46 VAL HB H 1 1.978 0.000 . . . . . . A 385 VAL HB . 34537 1 536 . 1 . 1 46 46 VAL HG11 H 1 0.949 0.000 . . . . . . A 385 VAL HG11 . 34537 1 537 . 1 . 1 46 46 VAL HG12 H 1 0.949 0.000 . . . . . . A 385 VAL HG12 . 34537 1 538 . 1 . 1 46 46 VAL HG13 H 1 0.949 0.000 . . . . . . A 385 VAL HG13 . 34537 1 539 . 1 . 1 46 46 VAL HG21 H 1 0.923 0.000 . . . . . . A 385 VAL HG21 . 34537 1 540 . 1 . 1 46 46 VAL HG22 H 1 0.923 0.000 . . . . . . A 385 VAL HG22 . 34537 1 541 . 1 . 1 46 46 VAL HG23 H 1 0.923 0.000 . . . . . . A 385 VAL HG23 . 34537 1 542 . 1 . 1 46 46 VAL C C 13 176.167 0.000 . . . . . . A 385 VAL C . 34537 1 543 . 1 . 1 46 46 VAL CA C 13 61.588 0.085 . . . . . . A 385 VAL CA . 34537 1 544 . 1 . 1 46 46 VAL CB C 13 33.937 0.042 . . . . . . A 385 VAL CB . 34537 1 545 . 1 . 1 46 46 VAL CG1 C 13 21.968 0.057 . . . . . . A 385 VAL CG1 . 34537 1 546 . 1 . 1 46 46 VAL CG2 C 13 21.999 0.000 . . . . . . A 385 VAL CG2 . 34537 1 547 . 1 . 1 46 46 VAL N N 15 123.565 0.052 . . . . . . A 385 VAL N . 34537 1 548 . 1 . 1 47 47 THR H H 1 8.544 0.006 . . . . . . A 386 THR H . 34537 1 549 . 1 . 1 47 47 THR HA H 1 4.551 0.000 . . . . . . A 386 THR HA . 34537 1 550 . 1 . 1 47 47 THR HB H 1 4.729 0.000 . . . . . . A 386 THR HB . 34537 1 551 . 1 . 1 47 47 THR HG1 H 1 5.567 0.000 . . . . . . A 386 THR HG1 . 34537 1 552 . 1 . 1 47 47 THR HG21 H 1 1.302 0.000 . . . . . . A 386 THR HG21 . 34537 1 553 . 1 . 1 47 47 THR HG22 H 1 1.302 0.000 . . . . . . A 386 THR HG22 . 34537 1 554 . 1 . 1 47 47 THR HG23 H 1 1.302 0.000 . . . . . . A 386 THR HG23 . 34537 1 555 . 1 . 1 47 47 THR C C 13 175.533 0.000 . . . . . . A 386 THR C . 34537 1 556 . 1 . 1 47 47 THR CA C 13 60.494 0.092 . . . . . . A 386 THR CA . 34537 1 557 . 1 . 1 47 47 THR CB C 13 71.703 0.079 . . . . . . A 386 THR CB . 34537 1 558 . 1 . 1 47 47 THR CG2 C 13 21.745 0.066 . . . . . . A 386 THR CG2 . 34537 1 559 . 1 . 1 47 47 THR N N 15 116.822 0.026 . . . . . . A 386 THR N . 34537 1 560 . 1 . 1 48 48 MET H H 1 9.016 0.006 . . . . . . A 387 MET H . 34537 1 561 . 1 . 1 48 48 MET HA H 1 4.004 0.000 . . . . . . A 387 MET HA . 34537 1 562 . 1 . 1 48 48 MET HB2 H 1 2.112 0.000 . . . . . . A 387 MET HB2 . 34537 1 563 . 1 . 1 48 48 MET HB3 H 1 2.030 0.000 . . . . . . A 387 MET HB3 . 34537 1 564 . 1 . 1 48 48 MET HG2 H 1 2.477 0.000 . . . . . . A 387 MET HG2 . 34537 1 565 . 1 . 1 48 48 MET HG3 H 1 2.409 0.000 . . . . . . A 387 MET HG3 . 34537 1 566 . 1 . 1 48 48 MET HE1 H 1 2.043 0.000 . . . . . . A 387 MET HE1 . 34537 1 567 . 1 . 1 48 48 MET HE2 H 1 2.043 0.000 . . . . . . A 387 MET HE2 . 34537 1 568 . 1 . 1 48 48 MET HE3 H 1 2.043 0.000 . . . . . . A 387 MET HE3 . 34537 1 569 . 1 . 1 48 48 MET C C 13 177.728 0.000 . . . . . . A 387 MET C . 34537 1 570 . 1 . 1 48 48 MET CA C 13 59.546 0.055 . . . . . . A 387 MET CA . 34537 1 571 . 1 . 1 48 48 MET CB C 13 32.392 0.000 . . . . . . A 387 MET CB . 34537 1 572 . 1 . 1 48 48 MET CG C 13 32.004 0.048 . . . . . . A 387 MET CG . 34537 1 573 . 1 . 1 48 48 MET CE C 13 17.536 0.000 . . . . . . A 387 MET CE . 34537 1 574 . 1 . 1 48 48 MET N N 15 121.087 0.040 . . . . . . A 387 MET N . 34537 1 575 . 1 . 1 49 49 GLN H H 1 8.388 0.001 . . . . . . A 388 GLN H . 34537 1 576 . 1 . 1 49 49 GLN HA H 1 4.029 0.000 . . . . . . A 388 GLN HA . 34537 1 577 . 1 . 1 49 49 GLN HB2 H 1 2.093 0.000 . . . . . . A 388 GLN HB2 . 34537 1 578 . 1 . 1 49 49 GLN HB3 H 1 1.999 0.000 . . . . . . A 388 GLN HB3 . 34537 1 579 . 1 . 1 49 49 GLN HG2 H 1 2.525 0.000 . . . . . . A 388 GLN HG2 . 34537 1 580 . 1 . 1 49 49 GLN HG3 H 1 2.467 0.000 . . . . . . A 388 GLN HG3 . 34537 1 581 . 1 . 1 49 49 GLN C C 13 179.301 0.000 . . . . . . A 388 GLN C . 34537 1 582 . 1 . 1 49 49 GLN CA C 13 59.587 0.053 . . . . . . A 388 GLN CA . 34537 1 583 . 1 . 1 49 49 GLN CB C 13 28.000 0.009 . . . . . . A 388 GLN CB . 34537 1 584 . 1 . 1 49 49 GLN CG C 13 34.599 0.043 . . . . . . A 388 GLN CG . 34537 1 585 . 1 . 1 49 49 GLN N N 15 116.696 0.033 . . . . . . A 388 GLN N . 34537 1 586 . 1 . 1 50 50 GLN H H 1 7.617 0.006 . . . . . . A 389 GLN H . 34537 1 587 . 1 . 1 50 50 GLN HA H 1 4.141 0.000 . . . . . . A 389 GLN HA . 34537 1 588 . 1 . 1 50 50 GLN HB2 H 1 2.436 0.000 . . . . . . A 389 GLN HB2 . 34537 1 589 . 1 . 1 50 50 GLN HB3 H 1 1.731 0.000 . . . . . . A 389 GLN HB3 . 34537 1 590 . 1 . 1 50 50 GLN HG2 H 1 2.538 0.000 . . . . . . A 389 GLN HG2 . 34537 1 591 . 1 . 1 50 50 GLN HG3 H 1 2.429 0.000 . . . . . . A 389 GLN HG3 . 34537 1 592 . 1 . 1 50 50 GLN HE21 H 1 7.584 0.000 . . . . . . A 389 GLN HE21 . 34537 1 593 . 1 . 1 50 50 GLN HE22 H 1 6.741 0.000 . . . . . . A 389 GLN HE22 . 34537 1 594 . 1 . 1 50 50 GLN C C 13 178.603 0.000 . . . . . . A 389 GLN C . 34537 1 595 . 1 . 1 50 50 GLN CA C 13 58.433 0.021 . . . . . . A 389 GLN CA . 34537 1 596 . 1 . 1 50 50 GLN CB C 13 28.591 0.044 . . . . . . A 389 GLN CB . 34537 1 597 . 1 . 1 50 50 GLN CG C 13 34.279 0.027 . . . . . . A 389 GLN CG . 34537 1 598 . 1 . 1 50 50 GLN N N 15 118.439 0.015 . . . . . . A 389 GLN N . 34537 1 599 . 1 . 1 50 50 GLN NE2 N 15 109.648 0.014 . . . . . . A 389 GLN NE2 . 34537 1 600 . 1 . 1 51 51 ALA H H 1 8.509 0.012 . . . . . . A 390 ALA H . 34537 1 601 . 1 . 1 51 51 ALA HA H 1 3.753 0.000 . . . . . . A 390 ALA HA . 34537 1 602 . 1 . 1 51 51 ALA HB1 H 1 1.343 0.000 . . . . . . A 390 ALA HB1 . 34537 1 603 . 1 . 1 51 51 ALA HB2 H 1 1.343 0.000 . . . . . . A 390 ALA HB2 . 34537 1 604 . 1 . 1 51 51 ALA HB3 H 1 1.343 0.000 . . . . . . A 390 ALA HB3 . 34537 1 605 . 1 . 1 51 51 ALA C C 13 178.899 0.000 . . . . . . A 390 ALA C . 34537 1 606 . 1 . 1 51 51 ALA CA C 13 55.376 0.025 . . . . . . A 390 ALA CA . 34537 1 607 . 1 . 1 51 51 ALA CB C 13 18.474 0.018 . . . . . . A 390 ALA CB . 34537 1 608 . 1 . 1 51 51 ALA N N 15 121.371 0.035 . . . . . . A 390 ALA N . 34537 1 609 . 1 . 1 52 52 GLN H H 1 7.949 0.015 . . . . . . A 391 GLN H . 34537 1 610 . 1 . 1 52 52 GLN HA H 1 3.920 0.000 . . . . . . A 391 GLN HA . 34537 1 611 . 1 . 1 52 52 GLN HB2 H 1 2.177 0.000 . . . . . . A 391 GLN HB2 . 34537 1 612 . 1 . 1 52 52 GLN HB3 H 1 2.092 0.000 . . . . . . A 391 GLN HB3 . 34537 1 613 . 1 . 1 52 52 GLN HG2 H 1 2.532 0.000 . . . . . . A 391 GLN HG2 . 34537 1 614 . 1 . 1 52 52 GLN HG3 H 1 2.378 0.000 . . . . . . A 391 GLN HG3 . 34537 1 615 . 1 . 1 52 52 GLN HE21 H 1 7.297 0.000 . . . . . . A 391 GLN HE21 . 34537 1 616 . 1 . 1 52 52 GLN HE22 H 1 6.786 0.000 . . . . . . A 391 GLN HE22 . 34537 1 617 . 1 . 1 52 52 GLN C C 13 177.559 0.000 . . . . . . A 391 GLN C . 34537 1 618 . 1 . 1 52 52 GLN CA C 13 58.439 0.069 . . . . . . A 391 GLN CA . 34537 1 619 . 1 . 1 52 52 GLN CB C 13 28.722 0.007 . . . . . . A 391 GLN CB . 34537 1 620 . 1 . 1 52 52 GLN CG C 13 34.303 0.025 . . . . . . A 391 GLN CG . 34537 1 621 . 1 . 1 52 52 GLN N N 15 113.974 0.007 . . . . . . A 391 GLN N . 34537 1 622 . 1 . 1 52 52 GLN NE2 N 15 111.303 0.009 . . . . . . A 391 GLN NE2 . 34537 1 623 . 1 . 1 53 53 LYS H H 1 7.478 0.003 . . . . . . A 392 LYS H . 34537 1 624 . 1 . 1 53 53 LYS HA H 1 4.218 0.000 . . . . . . A 392 LYS HA . 34537 1 625 . 1 . 1 53 53 LYS HB2 H 1 1.752 0.000 . . . . . . A 392 LYS HB2 . 34537 1 626 . 1 . 1 53 53 LYS HB3 H 1 1.752 0.000 . . . . . . A 392 LYS HB3 . 34537 1 627 . 1 . 1 53 53 LYS HG2 H 1 1.428 0.000 . . . . . . A 392 LYS HG2 . 34537 1 628 . 1 . 1 53 53 LYS HG3 H 1 1.271 0.000 . . . . . . A 392 LYS HG3 . 34537 1 629 . 1 . 1 53 53 LYS HD2 H 1 1.689 0.000 . . . . . . A 392 LYS HD2 . 34537 1 630 . 1 . 1 53 53 LYS HD3 H 1 1.689 0.000 . . . . . . A 392 LYS HD3 . 34537 1 631 . 1 . 1 53 53 LYS HE2 H 1 3.010 0.000 . . . . . . A 392 LYS HE2 . 34537 1 632 . 1 . 1 53 53 LYS HE3 H 1 3.010 0.000 . . . . . . A 392 LYS HE3 . 34537 1 633 . 1 . 1 53 53 LYS C C 13 177.038 0.000 . . . . . . A 392 LYS C . 34537 1 634 . 1 . 1 53 53 LYS CA C 13 57.442 0.056 . . . . . . A 392 LYS CA . 34537 1 635 . 1 . 1 53 53 LYS CB C 13 32.789 0.035 . . . . . . A 392 LYS CB . 34537 1 636 . 1 . 1 53 53 LYS CG C 13 25.136 0.120 . . . . . . A 392 LYS CG . 34537 1 637 . 1 . 1 53 53 LYS CD C 13 29.211 0.000 . . . . . . A 392 LYS CD . 34537 1 638 . 1 . 1 53 53 LYS CE C 13 42.123 0.000 . . . . . . A 392 LYS CE . 34537 1 639 . 1 . 1 53 53 LYS N N 15 117.093 0.026 . . . . . . A 392 LYS N . 34537 1 640 . 1 . 1 54 54 HIS H H 1 7.851 0.006 . . . . . . A 393 HIS H . 34537 1 641 . 1 . 1 54 54 HIS HA H 1 4.849 0.000 . . . . . . A 393 HIS HA . 34537 1 642 . 1 . 1 54 54 HIS HB2 H 1 3.315 0.000 . . . . . . A 393 HIS HB2 . 34537 1 643 . 1 . 1 54 54 HIS HB3 H 1 2.574 0.000 . . . . . . A 393 HIS HB3 . 34537 1 644 . 1 . 1 54 54 HIS HD2 H 1 7.402 0.000 . . . . . . A 393 HIS HD2 . 34537 1 645 . 1 . 1 54 54 HIS HE1 H 1 7.954 0.000 . . . . . . A 393 HIS HE1 . 34537 1 646 . 1 . 1 54 54 HIS C C 13 175.906 0.000 . . . . . . A 393 HIS C . 34537 1 647 . 1 . 1 54 54 HIS CA C 13 55.985 0.075 . . . . . . A 393 HIS CA . 34537 1 648 . 1 . 1 54 54 HIS CB C 13 29.843 0.022 . . . . . . A 393 HIS CB . 34537 1 649 . 1 . 1 54 54 HIS CD2 C 13 120.011 0.000 . . . . . . A 393 HIS CD2 . 34537 1 650 . 1 . 1 54 54 HIS CE1 C 13 137.889 0.000 . . . . . . A 393 HIS CE1 . 34537 1 651 . 1 . 1 54 54 HIS N N 15 120.004 0.043 . . . . . . A 393 HIS N . 34537 1 652 . 1 . 1 55 55 THR H H 1 7.458 0.011 . . . . . . A 394 THR H . 34537 1 653 . 1 . 1 55 55 THR HA H 1 3.859 0.000 . . . . . . A 394 THR HA . 34537 1 654 . 1 . 1 55 55 THR HB H 1 4.198 0.000 . . . . . . A 394 THR HB . 34537 1 655 . 1 . 1 55 55 THR HG21 H 1 1.263 0.001 . . . . . . A 394 THR HG21 . 34537 1 656 . 1 . 1 55 55 THR HG22 H 1 1.263 0.001 . . . . . . A 394 THR HG22 . 34537 1 657 . 1 . 1 55 55 THR HG23 H 1 1.263 0.001 . . . . . . A 394 THR HG23 . 34537 1 658 . 1 . 1 55 55 THR C C 13 177.384 0.000 . . . . . . A 394 THR C . 34537 1 659 . 1 . 1 55 55 THR CA C 13 65.854 0.055 . . . . . . A 394 THR CA . 34537 1 660 . 1 . 1 55 55 THR CB C 13 68.651 0.051 . . . . . . A 394 THR CB . 34537 1 661 . 1 . 1 55 55 THR CG2 C 13 22.123 0.007 . . . . . . A 394 THR CG2 . 34537 1 662 . 1 . 1 55 55 THR N N 15 113.169 0.043 . . . . . . A 394 THR N . 34537 1 663 . 1 . 1 56 56 GLU H H 1 8.908 0.007 . . . . . . A 395 GLU H . 34537 1 664 . 1 . 1 56 56 GLU HA H 1 4.141 0.001 . . . . . . A 395 GLU HA . 34537 1 665 . 1 . 1 56 56 GLU HB2 H 1 2.133 0.000 . . . . . . A 395 GLU HB2 . 34537 1 666 . 1 . 1 56 56 GLU HB3 H 1 2.133 0.000 . . . . . . A 395 GLU HB3 . 34537 1 667 . 1 . 1 56 56 GLU HG2 H 1 2.439 0.000 . . . . . . A 395 GLU HG2 . 34537 1 668 . 1 . 1 56 56 GLU HG3 H 1 2.351 0.000 . . . . . . A 395 GLU HG3 . 34537 1 669 . 1 . 1 56 56 GLU CA C 13 59.756 0.019 . . . . . . A 395 GLU CA . 34537 1 670 . 1 . 1 56 56 GLU CB C 13 28.690 0.061 . . . . . . A 395 GLU CB . 34537 1 671 . 1 . 1 56 56 GLU CG C 13 36.625 0.058 . . . . . . A 395 GLU CG . 34537 1 672 . 1 . 1 56 56 GLU N N 15 122.393 0.016 . . . . . . A 395 GLU N . 34537 1 673 . 1 . 1 57 57 MET H H 1 7.818 0.008 . . . . . . A 396 MET H . 34537 1 674 . 1 . 1 57 57 MET HA H 1 3.084 0.000 . . . . . . A 396 MET HA . 34537 1 675 . 1 . 1 57 57 MET HB2 H 1 2.122 0.000 . . . . . . A 396 MET HB2 . 34537 1 676 . 1 . 1 57 57 MET HB3 H 1 1.516 0.000 . . . . . . A 396 MET HB3 . 34537 1 677 . 1 . 1 57 57 MET HG2 H 1 2.056 0.000 . . . . . . A 396 MET HG2 . 34537 1 678 . 1 . 1 57 57 MET HG3 H 1 1.996 0.000 . . . . . . A 396 MET HG3 . 34537 1 679 . 1 . 1 57 57 MET HE1 H 1 1.711 0.000 . . . . . . A 396 MET HE1 . 34537 1 680 . 1 . 1 57 57 MET HE2 H 1 1.711 0.000 . . . . . . A 396 MET HE2 . 34537 1 681 . 1 . 1 57 57 MET HE3 H 1 1.711 0.000 . . . . . . A 396 MET HE3 . 34537 1 682 . 1 . 1 57 57 MET C C 13 177.320 0.000 . . . . . . A 396 MET C . 34537 1 683 . 1 . 1 57 57 MET CA C 13 58.290 0.055 . . . . . . A 396 MET CA . 34537 1 684 . 1 . 1 57 57 MET CB C 13 32.656 0.025 . . . . . . A 396 MET CB . 34537 1 685 . 1 . 1 57 57 MET CG C 13 31.470 0.020 . . . . . . A 396 MET CG . 34537 1 686 . 1 . 1 57 57 MET CE C 13 17.095 0.000 . . . . . . A 396 MET CE . 34537 1 687 . 1 . 1 57 57 MET N N 15 120.237 0.052 . . . . . . A 396 MET N . 34537 1 688 . 1 . 1 58 58 ILE H H 1 7.385 0.007 . . . . . . A 397 ILE H . 34537 1 689 . 1 . 1 58 58 ILE HA H 1 3.571 0.000 . . . . . . A 397 ILE HA . 34537 1 690 . 1 . 1 58 58 ILE HB H 1 2.085 0.000 . . . . . . A 397 ILE HB . 34537 1 691 . 1 . 1 58 58 ILE HG12 H 1 1.541 0.000 . . . . . . A 397 ILE HG12 . 34537 1 692 . 1 . 1 58 58 ILE HG13 H 1 0.895 0.000 . . . . . . A 397 ILE HG13 . 34537 1 693 . 1 . 1 58 58 ILE HG21 H 1 1.078 0.000 . . . . . . A 397 ILE HG21 . 34537 1 694 . 1 . 1 58 58 ILE HG22 H 1 1.078 0.000 . . . . . . A 397 ILE HG22 . 34537 1 695 . 1 . 1 58 58 ILE HG23 H 1 1.078 0.000 . . . . . . A 397 ILE HG23 . 34537 1 696 . 1 . 1 58 58 ILE HD11 H 1 0.668 0.000 . . . . . . A 397 ILE HD11 . 34537 1 697 . 1 . 1 58 58 ILE HD12 H 1 0.668 0.000 . . . . . . A 397 ILE HD12 . 34537 1 698 . 1 . 1 58 58 ILE HD13 H 1 0.668 0.000 . . . . . . A 397 ILE HD13 . 34537 1 699 . 1 . 1 58 58 ILE C C 13 177.585 0.000 . . . . . . A 397 ILE C . 34537 1 700 . 1 . 1 58 58 ILE CA C 13 65.468 0.004 . . . . . . A 397 ILE CA . 34537 1 701 . 1 . 1 58 58 ILE CB C 13 36.987 0.068 . . . . . . A 397 ILE CB . 34537 1 702 . 1 . 1 58 58 ILE CG1 C 13 29.256 0.014 . . . . . . A 397 ILE CG1 . 34537 1 703 . 1 . 1 58 58 ILE CG2 C 13 18.252 0.029 . . . . . . A 397 ILE CG2 . 34537 1 704 . 1 . 1 58 58 ILE CD1 C 13 13.071 0.000 . . . . . . A 397 ILE CD1 . 34537 1 705 . 1 . 1 58 58 ILE N N 15 119.370 0.062 . . . . . . A 397 ILE N . 34537 1 706 . 1 . 1 59 59 THR H H 1 7.956 0.009 . . . . . . A 398 THR H . 34537 1 707 . 1 . 1 59 59 THR HA H 1 3.926 0.000 . . . . . . A 398 THR HA . 34537 1 708 . 1 . 1 59 59 THR HB H 1 4.419 0.000 . . . . . . A 398 THR HB . 34537 1 709 . 1 . 1 59 59 THR HG21 H 1 1.288 0.000 . . . . . . A 398 THR HG21 . 34537 1 710 . 1 . 1 59 59 THR HG22 H 1 1.288 0.000 . . . . . . A 398 THR HG22 . 34537 1 711 . 1 . 1 59 59 THR HG23 H 1 1.288 0.000 . . . . . . A 398 THR HG23 . 34537 1 712 . 1 . 1 59 59 THR C C 13 176.615 0.000 . . . . . . A 398 THR C . 34537 1 713 . 1 . 1 59 59 THR CA C 13 66.901 0.053 . . . . . . A 398 THR CA . 34537 1 714 . 1 . 1 59 59 THR CB C 13 68.416 0.089 . . . . . . A 398 THR CB . 34537 1 715 . 1 . 1 59 59 THR CG2 C 13 22.569 0.029 . . . . . . A 398 THR CG2 . 34537 1 716 . 1 . 1 59 59 THR N N 15 117.587 0.013 . . . . . . A 398 THR N . 34537 1 717 . 1 . 1 60 60 THR H H 1 8.232 0.013 . . . . . . A 399 THR H . 34537 1 718 . 1 . 1 60 60 THR HA H 1 4.466 0.010 . . . . . . A 399 THR HA . 34537 1 719 . 1 . 1 60 60 THR HB H 1 4.430 0.000 . . . . . . A 399 THR HB . 34537 1 720 . 1 . 1 60 60 THR HG1 H 1 3.865 0.000 . . . . . . A 399 THR HG1 . 34537 1 721 . 1 . 1 60 60 THR HG21 H 1 1.191 0.004 . . . . . . A 399 THR HG21 . 34537 1 722 . 1 . 1 60 60 THR HG22 H 1 1.191 0.004 . . . . . . A 399 THR HG22 . 34537 1 723 . 1 . 1 60 60 THR HG23 H 1 1.191 0.004 . . . . . . A 399 THR HG23 . 34537 1 724 . 1 . 1 60 60 THR C C 13 175.962 0.000 . . . . . . A 399 THR C . 34537 1 725 . 1 . 1 60 60 THR CA C 13 67.124 0.154 . . . . . . A 399 THR CA . 34537 1 726 . 1 . 1 60 60 THR CB C 13 68.323 0.013 . . . . . . A 399 THR CB . 34537 1 727 . 1 . 1 60 60 THR CG2 C 13 23.313 0.032 . . . . . . A 399 THR CG2 . 34537 1 728 . 1 . 1 60 60 THR N N 15 121.472 0.019 . . . . . . A 399 THR N . 34537 1 729 . 1 . 1 61 61 LEU H H 1 8.100 0.004 . . . . . . A 400 LEU H . 34537 1 730 . 1 . 1 61 61 LEU HA H 1 3.926 0.000 . . . . . . A 400 LEU HA . 34537 1 731 . 1 . 1 61 61 LEU HB2 H 1 2.313 0.000 . . . . . . A 400 LEU HB2 . 34537 1 732 . 1 . 1 61 61 LEU HB3 H 1 1.478 0.000 . . . . . . A 400 LEU HB3 . 34537 1 733 . 1 . 1 61 61 LEU HG H 1 1.996 0.000 . . . . . . A 400 LEU HG . 34537 1 734 . 1 . 1 61 61 LEU HD11 H 1 0.888 0.000 . . . . . . A 400 LEU HD11 . 34537 1 735 . 1 . 1 61 61 LEU HD12 H 1 0.888 0.000 . . . . . . A 400 LEU HD12 . 34537 1 736 . 1 . 1 61 61 LEU HD13 H 1 0.888 0.000 . . . . . . A 400 LEU HD13 . 34537 1 737 . 1 . 1 61 61 LEU HD21 H 1 0.801 0.000 . . . . . . A 400 LEU HD21 . 34537 1 738 . 1 . 1 61 61 LEU HD22 H 1 0.801 0.000 . . . . . . A 400 LEU HD22 . 34537 1 739 . 1 . 1 61 61 LEU HD23 H 1 0.801 0.000 . . . . . . A 400 LEU HD23 . 34537 1 740 . 1 . 1 61 61 LEU C C 13 177.505 0.000 . . . . . . A 400 LEU C . 34537 1 741 . 1 . 1 61 61 LEU CA C 13 58.140 0.064 . . . . . . A 400 LEU CA . 34537 1 742 . 1 . 1 61 61 LEU CB C 13 42.192 0.049 . . . . . . A 400 LEU CB . 34537 1 743 . 1 . 1 61 61 LEU CG C 13 26.429 0.008 . . . . . . A 400 LEU CG . 34537 1 744 . 1 . 1 61 61 LEU CD1 C 13 26.312 0.000 . . . . . . A 400 LEU CD1 . 34537 1 745 . 1 . 1 61 61 LEU CD2 C 13 22.813 0.000 . . . . . . A 400 LEU CD2 . 34537 1 746 . 1 . 1 61 61 LEU N N 15 119.581 0.042 . . . . . . A 400 LEU N . 34537 1 747 . 1 . 1 62 62 LYS H H 1 8.040 0.018 . . . . . . A 401 LYS H . 34537 1 748 . 1 . 1 62 62 LYS HA H 1 3.001 0.000 . . . . . . A 401 LYS HA . 34537 1 749 . 1 . 1 62 62 LYS HB2 H 1 1.978 0.000 . . . . . . A 401 LYS HB2 . 34537 1 750 . 1 . 1 62 62 LYS HB3 H 1 1.639 0.000 . . . . . . A 401 LYS HB3 . 34537 1 751 . 1 . 1 62 62 LYS HG2 H 1 1.079 0.000 . . . . . . A 401 LYS HG2 . 34537 1 752 . 1 . 1 62 62 LYS HG3 H 1 0.620 0.000 . . . . . . A 401 LYS HG3 . 34537 1 753 . 1 . 1 62 62 LYS HD2 H 1 1.614 0.000 . . . . . . A 401 LYS HD2 . 34537 1 754 . 1 . 1 62 62 LYS HD3 H 1 1.587 0.000 . . . . . . A 401 LYS HD3 . 34537 1 755 . 1 . 1 62 62 LYS HE2 H 1 2.957 0.000 . . . . . . A 401 LYS HE2 . 34537 1 756 . 1 . 1 62 62 LYS HE3 H 1 2.882 0.000 . . . . . . A 401 LYS HE3 . 34537 1 757 . 1 . 1 62 62 LYS C C 13 179.700 0.000 . . . . . . A 401 LYS C . 34537 1 758 . 1 . 1 62 62 LYS CA C 13 59.365 0.000 . . . . . . A 401 LYS CA . 34537 1 759 . 1 . 1 62 62 LYS CB C 13 33.067 0.000 . . . . . . A 401 LYS CB . 34537 1 760 . 1 . 1 62 62 LYS CG C 13 25.546 0.069 . . . . . . A 401 LYS CG . 34537 1 761 . 1 . 1 62 62 LYS CD C 13 29.910 0.001 . . . . . . A 401 LYS CD . 34537 1 762 . 1 . 1 62 62 LYS CE C 13 42.219 0.053 . . . . . . A 401 LYS CE . 34537 1 763 . 1 . 1 62 62 LYS N N 15 117.084 0.048 . . . . . . A 401 LYS N . 34537 1 764 . 1 . 1 63 63 LYS H H 1 7.786 0.004 . . . . . . A 402 LYS H . 34537 1 765 . 1 . 1 63 63 LYS HA H 1 4.046 0.000 . . . . . . A 402 LYS HA . 34537 1 766 . 1 . 1 63 63 LYS HB2 H 1 2.022 0.000 . . . . . . A 402 LYS HB2 . 34537 1 767 . 1 . 1 63 63 LYS HB3 H 1 1.978 0.000 . . . . . . A 402 LYS HB3 . 34537 1 768 . 1 . 1 63 63 LYS HG2 H 1 1.655 0.000 . . . . . . A 402 LYS HG2 . 34537 1 769 . 1 . 1 63 63 LYS HG3 H 1 1.452 0.000 . . . . . . A 402 LYS HG3 . 34537 1 770 . 1 . 1 63 63 LYS HD2 H 1 1.707 0.000 . . . . . . A 402 LYS HD2 . 34537 1 771 . 1 . 1 63 63 LYS HD3 H 1 1.707 0.000 . . . . . . A 402 LYS HD3 . 34537 1 772 . 1 . 1 63 63 LYS HE2 H 1 2.965 0.000 . . . . . . A 402 LYS HE2 . 34537 1 773 . 1 . 1 63 63 LYS HE3 H 1 2.965 0.000 . . . . . . A 402 LYS HE3 . 34537 1 774 . 1 . 1 63 63 LYS C C 13 179.876 0.000 . . . . . . A 402 LYS C . 34537 1 775 . 1 . 1 63 63 LYS CA C 13 59.212 0.079 . . . . . . A 402 LYS CA . 34537 1 776 . 1 . 1 63 63 LYS CB C 13 32.988 0.056 . . . . . . A 402 LYS CB . 34537 1 777 . 1 . 1 63 63 LYS CG C 13 25.559 0.031 . . . . . . A 402 LYS CG . 34537 1 778 . 1 . 1 63 63 LYS CD C 13 29.533 0.000 . . . . . . A 402 LYS CD . 34537 1 779 . 1 . 1 63 63 LYS CE C 13 42.214 0.000 . . . . . . A 402 LYS CE . 34537 1 780 . 1 . 1 63 63 LYS N N 15 117.884 0.017 . . . . . . A 402 LYS N . 34537 1 781 . 1 . 1 64 64 ILE H H 1 7.943 0.017 . . . . . . A 403 ILE H . 34537 1 782 . 1 . 1 64 64 ILE HA H 1 4.008 0.000 . . . . . . A 403 ILE HA . 34537 1 783 . 1 . 1 64 64 ILE HB H 1 1.963 0.000 . . . . . . A 403 ILE HB . 34537 1 784 . 1 . 1 64 64 ILE HG12 H 1 1.641 0.000 . . . . . . A 403 ILE HG12 . 34537 1 785 . 1 . 1 64 64 ILE HG13 H 1 1.440 0.000 . . . . . . A 403 ILE HG13 . 34537 1 786 . 1 . 1 64 64 ILE HG21 H 1 0.801 0.000 . . . . . . A 403 ILE HG21 . 34537 1 787 . 1 . 1 64 64 ILE HG22 H 1 0.801 0.000 . . . . . . A 403 ILE HG22 . 34537 1 788 . 1 . 1 64 64 ILE HG23 H 1 0.801 0.000 . . . . . . A 403 ILE HG23 . 34537 1 789 . 1 . 1 64 64 ILE HD11 H 1 0.678 0.000 . . . . . . A 403 ILE HD11 . 34537 1 790 . 1 . 1 64 64 ILE HD12 H 1 0.678 0.000 . . . . . . A 403 ILE HD12 . 34537 1 791 . 1 . 1 64 64 ILE HD13 H 1 0.678 0.000 . . . . . . A 403 ILE HD13 . 34537 1 792 . 1 . 1 64 64 ILE C C 13 176.042 0.000 . . . . . . A 403 ILE C . 34537 1 793 . 1 . 1 64 64 ILE CA C 13 64.531 0.052 . . . . . . A 403 ILE CA . 34537 1 794 . 1 . 1 64 64 ILE CB C 13 37.192 0.067 . . . . . . A 403 ILE CB . 34537 1 795 . 1 . 1 64 64 ILE CG1 C 13 26.274 0.035 . . . . . . A 403 ILE CG1 . 34537 1 796 . 1 . 1 64 64 ILE CG2 C 13 17.460 0.048 . . . . . . A 403 ILE CG2 . 34537 1 797 . 1 . 1 64 64 ILE CD1 C 13 14.452 0.000 . . . . . . A 403 ILE CD1 . 34537 1 798 . 1 . 1 64 64 ILE N N 15 115.220 0.186 . . . . . . A 403 ILE N . 34537 1 799 . 1 . 1 65 65 ARG H H 1 7.135 0.007 . . . . . . A 404 ARG H . 34537 1 800 . 1 . 1 65 65 ARG HA H 1 4.245 0.000 . . . . . . A 404 ARG HA . 34537 1 801 . 1 . 1 65 65 ARG HB2 H 1 1.816 0.000 . . . . . . A 404 ARG HB2 . 34537 1 802 . 1 . 1 65 65 ARG HB3 H 1 1.748 0.000 . . . . . . A 404 ARG HB3 . 34537 1 803 . 1 . 1 65 65 ARG HG2 H 1 1.996 0.000 . . . . . . A 404 ARG HG2 . 34537 1 804 . 1 . 1 65 65 ARG HG3 H 1 1.650 0.000 . . . . . . A 404 ARG HG3 . 34537 1 805 . 1 . 1 65 65 ARG HD2 H 1 3.130 0.000 . . . . . . A 404 ARG HD2 . 34537 1 806 . 1 . 1 65 65 ARG HD3 H 1 3.059 0.000 . . . . . . A 404 ARG HD3 . 34537 1 807 . 1 . 1 65 65 ARG C C 13 176.602 0.000 . . . . . . A 404 ARG C . 34537 1 808 . 1 . 1 65 65 ARG CA C 13 58.697 0.027 . . . . . . A 404 ARG CA . 34537 1 809 . 1 . 1 65 65 ARG CB C 13 30.564 0.020 . . . . . . A 404 ARG CB . 34537 1 810 . 1 . 1 65 65 ARG CG C 13 25.627 0.072 . . . . . . A 404 ARG CG . 34537 1 811 . 1 . 1 65 65 ARG CD C 13 44.193 0.038 . . . . . . A 404 ARG CD . 34537 1 812 . 1 . 1 65 65 ARG N N 15 118.215 0.172 . . . . . . A 404 ARG N . 34537 1 813 . 1 . 1 66 66 ARG H H 1 7.275 0.021 . . . . . . A 405 ARG H . 34537 1 814 . 1 . 1 66 66 ARG HA H 1 4.434 0.000 . . . . . . A 405 ARG HA . 34537 1 815 . 1 . 1 66 66 ARG HB2 H 1 2.075 0.000 . . . . . . A 405 ARG HB2 . 34537 1 816 . 1 . 1 66 66 ARG HB3 H 1 1.717 0.000 . . . . . . A 405 ARG HB3 . 34537 1 817 . 1 . 1 66 66 ARG HG2 H 1 1.627 0.000 . . . . . . A 405 ARG HG2 . 34537 1 818 . 1 . 1 66 66 ARG HG3 H 1 1.545 0.000 . . . . . . A 405 ARG HG3 . 34537 1 819 . 1 . 1 66 66 ARG HD2 H 1 3.175 0.000 . . . . . . A 405 ARG HD2 . 34537 1 820 . 1 . 1 66 66 ARG HD3 H 1 3.175 0.000 . . . . . . A 405 ARG HD3 . 34537 1 821 . 1 . 1 66 66 ARG HE H 1 7.474 0.000 . . . . . . A 405 ARG HE . 34537 1 822 . 1 . 1 66 66 ARG C C 13 176.417 0.000 . . . . . . A 405 ARG C . 34537 1 823 . 1 . 1 66 66 ARG CA C 13 54.707 0.100 . . . . . . A 405 ARG CA . 34537 1 824 . 1 . 1 66 66 ARG CB C 13 29.708 0.052 . . . . . . A 405 ARG CB . 34537 1 825 . 1 . 1 66 66 ARG CG C 13 27.196 0.005 . . . . . . A 405 ARG CG . 34537 1 826 . 1 . 1 66 66 ARG CD C 13 43.307 0.043 . . . . . . A 405 ARG CD . 34537 1 827 . 1 . 1 66 66 ARG N N 15 113.383 0.177 . . . . . . A 405 ARG N . 34537 1 828 . 1 . 1 66 66 ARG NE N 15 82.646 0.000 . . . . . . A 405 ARG NE . 34537 1 829 . 1 . 1 67 67 PHE H H 1 7.621 0.014 . . . . . . A 406 PHE H . 34537 1 830 . 1 . 1 67 67 PHE HA H 1 4.670 0.000 . . . . . . A 406 PHE HA . 34537 1 831 . 1 . 1 67 67 PHE HB2 H 1 3.125 0.000 . . . . . . A 406 PHE HB2 . 34537 1 832 . 1 . 1 67 67 PHE HB3 H 1 3.249 0.000 . . . . . . A 406 PHE HB3 . 34537 1 833 . 1 . 1 67 67 PHE HD1 H 1 7.343 0.000 . . . . . . A 406 PHE HD1 . 34537 1 834 . 1 . 1 67 67 PHE HD2 H 1 7.343 0.000 . . . . . . A 406 PHE HD2 . 34537 1 835 . 1 . 1 67 67 PHE HE1 H 1 7.265 0.000 . . . . . . A 406 PHE HE1 . 34537 1 836 . 1 . 1 67 67 PHE HE2 H 1 7.265 0.000 . . . . . . A 406 PHE HE2 . 34537 1 837 . 1 . 1 67 67 PHE HZ H 1 7.258 0.000 . . . . . . A 406 PHE HZ . 34537 1 838 . 1 . 1 67 67 PHE C C 13 174.370 0.000 . . . . . . A 406 PHE C . 34537 1 839 . 1 . 1 67 67 PHE CA C 13 57.884 0.077 . . . . . . A 406 PHE CA . 34537 1 840 . 1 . 1 67 67 PHE CB C 13 38.712 0.134 . . . . . . A 406 PHE CB . 34537 1 841 . 1 . 1 67 67 PHE CD1 C 13 131.624 0.000 . . . . . . A 406 PHE CD1 . 34537 1 842 . 1 . 1 67 67 PHE CE1 C 13 131.602 0.000 . . . . . . A 406 PHE CE1 . 34537 1 843 . 1 . 1 67 67 PHE CZ C 13 129.839 0.000 . . . . . . A 406 PHE CZ . 34537 1 844 . 1 . 1 67 67 PHE N N 15 121.964 0.076 . . . . . . A 406 PHE N . 34537 1 845 . 1 . 1 68 68 LYS H H 1 7.967 0.035 . . . . . . A 407 LYS H . 34537 1 846 . 1 . 1 68 68 LYS HA H 1 4.270 0.000 . . . . . . A 407 LYS HA . 34537 1 847 . 1 . 1 68 68 LYS HB2 H 1 1.817 0.000 . . . . . . A 407 LYS HB2 . 34537 1 848 . 1 . 1 68 68 LYS HB3 H 1 1.729 0.000 . . . . . . A 407 LYS HB3 . 34537 1 849 . 1 . 1 68 68 LYS HG2 H 1 1.438 0.000 . . . . . . A 407 LYS HG2 . 34537 1 850 . 1 . 1 68 68 LYS HG3 H 1 1.438 0.000 . . . . . . A 407 LYS HG3 . 34537 1 851 . 1 . 1 68 68 LYS HD2 H 1 1.685 0.000 . . . . . . A 407 LYS HD2 . 34537 1 852 . 1 . 1 68 68 LYS HD3 H 1 1.685 0.000 . . . . . . A 407 LYS HD3 . 34537 1 853 . 1 . 1 68 68 LYS HE2 H 1 3.008 0.000 . . . . . . A 407 LYS HE2 . 34537 1 854 . 1 . 1 68 68 LYS HE3 H 1 3.008 0.000 . . . . . . A 407 LYS HE3 . 34537 1 855 . 1 . 1 68 68 LYS C C 13 176.627 0.000 . . . . . . A 407 LYS C . 34537 1 856 . 1 . 1 68 68 LYS CA C 13 57.777 0.013 . . . . . . A 407 LYS CA . 34537 1 857 . 1 . 1 68 68 LYS CB C 13 32.092 0.048 . . . . . . A 407 LYS CB . 34537 1 858 . 1 . 1 68 68 LYS CG C 13 24.734 0.011 . . . . . . A 407 LYS CG . 34537 1 859 . 1 . 1 68 68 LYS CD C 13 29.236 0.064 . . . . . . A 407 LYS CD . 34537 1 860 . 1 . 1 68 68 LYS CE C 13 42.106 0.000 . . . . . . A 407 LYS CE . 34537 1 861 . 1 . 1 68 68 LYS N N 15 123.992 0.050 . . . . . . A 407 LYS N . 34537 1 862 . 1 . 1 69 69 VAL H H 1 6.801 0.039 . . . . . . A 408 VAL H . 34537 1 863 . 1 . 1 69 69 VAL HA H 1 3.936 0.000 . . . . . . A 408 VAL HA . 34537 1 864 . 1 . 1 69 69 VAL HB H 1 1.568 0.000 . . . . . . A 408 VAL HB . 34537 1 865 . 1 . 1 69 69 VAL HG11 H 1 0.743 0.000 . . . . . . A 408 VAL HG11 . 34537 1 866 . 1 . 1 69 69 VAL HG12 H 1 0.743 0.000 . . . . . . A 408 VAL HG12 . 34537 1 867 . 1 . 1 69 69 VAL HG13 H 1 0.743 0.000 . . . . . . A 408 VAL HG13 . 34537 1 868 . 1 . 1 69 69 VAL HG21 H 1 0.830 0.000 . . . . . . A 408 VAL HG21 . 34537 1 869 . 1 . 1 69 69 VAL HG22 H 1 0.830 0.000 . . . . . . A 408 VAL HG22 . 34537 1 870 . 1 . 1 69 69 VAL HG23 H 1 0.830 0.000 . . . . . . A 408 VAL HG23 . 34537 1 871 . 1 . 1 69 69 VAL C C 13 175.480 0.000 . . . . . . A 408 VAL C . 34537 1 872 . 1 . 1 69 69 VAL CA C 13 62.675 0.114 . . . . . . A 408 VAL CA . 34537 1 873 . 1 . 1 69 69 VAL CB C 13 32.618 0.143 . . . . . . A 408 VAL CB . 34537 1 874 . 1 . 1 69 69 VAL CG1 C 13 20.847 0.000 . . . . . . A 408 VAL CG1 . 34537 1 875 . 1 . 1 69 69 VAL CG2 C 13 21.329 0.000 . . . . . . A 408 VAL CG2 . 34537 1 876 . 1 . 1 69 69 VAL N N 15 115.339 0.017 . . . . . . A 408 VAL N . 34537 1 877 . 1 . 1 70 70 SER H H 1 7.494 0.004 . . . . . . A 409 SER H . 34537 1 878 . 1 . 1 70 70 SER HA H 1 4.788 0.000 . . . . . . A 409 SER HA . 34537 1 879 . 1 . 1 70 70 SER HB2 H 1 4.019 0.000 . . . . . . A 409 SER HB2 . 34537 1 880 . 1 . 1 70 70 SER HB3 H 1 3.806 0.006 . . . . . . A 409 SER HB3 . 34537 1 881 . 1 . 1 70 70 SER CA C 13 56.407 0.020 . . . . . . A 409 SER CA . 34537 1 882 . 1 . 1 70 70 SER CB C 13 64.598 0.046 . . . . . . A 409 SER CB . 34537 1 883 . 1 . 1 70 70 SER N N 15 112.140 0.105 . . . . . . A 409 SER N . 34537 1 884 . 1 . 1 71 71 GLN HA H 1 4.113 0.000 . . . . . . A 410 GLN HA . 34537 1 885 . 1 . 1 71 71 GLN HB2 H 1 2.215 0.000 . . . . . . A 410 GLN HB2 . 34537 1 886 . 1 . 1 71 71 GLN HB3 H 1 2.105 0.000 . . . . . . A 410 GLN HB3 . 34537 1 887 . 1 . 1 71 71 GLN HG2 H 1 2.471 0.007 . . . . . . A 410 GLN HG2 . 34537 1 888 . 1 . 1 71 71 GLN HG3 H 1 2.471 0.007 . . . . . . A 410 GLN HG3 . 34537 1 889 . 1 . 1 71 71 GLN HE22 H 1 6.831 0.000 . . . . . . A 410 GLN HE22 . 34537 1 890 . 1 . 1 71 71 GLN C C 13 177.671 0.000 . . . . . . A 410 GLN C . 34537 1 891 . 1 . 1 71 71 GLN CA C 13 59.187 0.130 . . . . . . A 410 GLN CA . 34537 1 892 . 1 . 1 71 71 GLN CB C 13 28.237 0.009 . . . . . . A 410 GLN CB . 34537 1 893 . 1 . 1 71 71 GLN CG C 13 33.426 0.034 . . . . . . A 410 GLN CG . 34537 1 894 . 1 . 1 72 72 VAL H H 1 7.784 0.010 . . . . . . A 411 VAL H . 34537 1 895 . 1 . 1 72 72 VAL HA H 1 3.915 0.000 . . . . . . A 411 VAL HA . 34537 1 896 . 1 . 1 72 72 VAL HB H 1 1.862 0.000 . . . . . . A 411 VAL HB . 34537 1 897 . 1 . 1 72 72 VAL HG11 H 1 1.079 0.000 . . . . . . A 411 VAL HG11 . 34537 1 898 . 1 . 1 72 72 VAL HG12 H 1 1.079 0.000 . . . . . . A 411 VAL HG12 . 34537 1 899 . 1 . 1 72 72 VAL HG13 H 1 1.079 0.000 . . . . . . A 411 VAL HG13 . 34537 1 900 . 1 . 1 72 72 VAL HG21 H 1 0.986 0.000 . . . . . . A 411 VAL HG21 . 34537 1 901 . 1 . 1 72 72 VAL HG22 H 1 0.986 0.000 . . . . . . A 411 VAL HG22 . 34537 1 902 . 1 . 1 72 72 VAL HG23 H 1 0.986 0.000 . . . . . . A 411 VAL HG23 . 34537 1 903 . 1 . 1 72 72 VAL C C 13 178.327 0.000 . . . . . . A 411 VAL C . 34537 1 904 . 1 . 1 72 72 VAL CA C 13 66.120 0.014 . . . . . . A 411 VAL CA . 34537 1 905 . 1 . 1 72 72 VAL CB C 13 31.963 0.029 . . . . . . A 411 VAL CB . 34537 1 906 . 1 . 1 72 72 VAL CG1 C 13 22.111 0.000 . . . . . . A 411 VAL CG1 . 34537 1 907 . 1 . 1 72 72 VAL CG2 C 13 21.644 0.000 . . . . . . A 411 VAL CG2 . 34537 1 908 . 1 . 1 72 72 VAL N N 15 118.056 0.035 . . . . . . A 411 VAL N . 34537 1 909 . 1 . 1 73 73 ILE H H 1 7.581 0.012 . . . . . . A 412 ILE H . 34537 1 910 . 1 . 1 73 73 ILE HA H 1 3.484 0.000 . . . . . . A 412 ILE HA . 34537 1 911 . 1 . 1 73 73 ILE HB H 1 2.059 0.000 . . . . . . A 412 ILE HB . 34537 1 912 . 1 . 1 73 73 ILE HG12 H 1 1.830 0.000 . . . . . . A 412 ILE HG12 . 34537 1 913 . 1 . 1 73 73 ILE HG13 H 1 0.958 0.000 . . . . . . A 412 ILE HG13 . 34537 1 914 . 1 . 1 73 73 ILE HG21 H 1 0.924 0.000 . . . . . . A 412 ILE HG21 . 34537 1 915 . 1 . 1 73 73 ILE HG22 H 1 0.924 0.000 . . . . . . A 412 ILE HG22 . 34537 1 916 . 1 . 1 73 73 ILE HG23 H 1 0.924 0.000 . . . . . . A 412 ILE HG23 . 34537 1 917 . 1 . 1 73 73 ILE HD11 H 1 1.161 0.000 . . . . . . A 412 ILE HD11 . 34537 1 918 . 1 . 1 73 73 ILE HD12 H 1 1.161 0.000 . . . . . . A 412 ILE HD12 . 34537 1 919 . 1 . 1 73 73 ILE HD13 H 1 1.161 0.000 . . . . . . A 412 ILE HD13 . 34537 1 920 . 1 . 1 73 73 ILE C C 13 179.351 0.000 . . . . . . A 412 ILE C . 34537 1 921 . 1 . 1 73 73 ILE CA C 13 66.212 0.017 . . . . . . A 412 ILE CA . 34537 1 922 . 1 . 1 73 73 ILE CB C 13 37.725 0.022 . . . . . . A 412 ILE CB . 34537 1 923 . 1 . 1 73 73 ILE CG1 C 13 30.520 0.025 . . . . . . A 412 ILE CG1 . 34537 1 924 . 1 . 1 73 73 ILE CG2 C 13 17.225 0.015 . . . . . . A 412 ILE CG2 . 34537 1 925 . 1 . 1 73 73 ILE CD1 C 13 14.218 0.000 . . . . . . A 412 ILE CD1 . 34537 1 926 . 1 . 1 73 73 ILE N N 15 120.070 0.019 . . . . . . A 412 ILE N . 34537 1 927 . 1 . 1 74 74 MET H H 1 8.191 0.007 . . . . . . A 413 MET H . 34537 1 928 . 1 . 1 74 74 MET HA H 1 4.064 0.000 . . . . . . A 413 MET HA . 34537 1 929 . 1 . 1 74 74 MET HB2 H 1 2.342 0.000 . . . . . . A 413 MET HB2 . 34537 1 930 . 1 . 1 74 74 MET HB3 H 1 2.232 0.000 . . . . . . A 413 MET HB3 . 34537 1 931 . 1 . 1 74 74 MET HG2 H 1 2.867 0.005 . . . . . . A 413 MET HG2 . 34537 1 932 . 1 . 1 74 74 MET HG3 H 1 2.331 0.000 . . . . . . A 413 MET HG3 . 34537 1 933 . 1 . 1 74 74 MET HE1 H 1 2.102 0.000 . . . . . . A 413 MET HE1 . 34537 1 934 . 1 . 1 74 74 MET HE2 H 1 2.102 0.000 . . . . . . A 413 MET HE2 . 34537 1 935 . 1 . 1 74 74 MET HE3 H 1 2.102 0.000 . . . . . . A 413 MET HE3 . 34537 1 936 . 1 . 1 74 74 MET C C 13 178.927 0.000 . . . . . . A 413 MET C . 34537 1 937 . 1 . 1 74 74 MET CA C 13 60.731 0.093 . . . . . . A 413 MET CA . 34537 1 938 . 1 . 1 74 74 MET CB C 13 33.380 0.006 . . . . . . A 413 MET CB . 34537 1 939 . 1 . 1 74 74 MET CG C 13 32.105 0.018 . . . . . . A 413 MET CG . 34537 1 940 . 1 . 1 74 74 MET CE C 13 16.789 0.000 . . . . . . A 413 MET CE . 34537 1 941 . 1 . 1 74 74 MET N N 15 121.546 0.050 . . . . . . A 413 MET N . 34537 1 942 . 1 . 1 75 75 GLU H H 1 8.645 0.009 . . . . . . A 414 GLU H . 34537 1 943 . 1 . 1 75 75 GLU HA H 1 4.091 0.000 . . . . . . A 414 GLU HA . 34537 1 944 . 1 . 1 75 75 GLU HB2 H 1 2.264 0.000 . . . . . . A 414 GLU HB2 . 34537 1 945 . 1 . 1 75 75 GLU HB3 H 1 2.138 0.000 . . . . . . A 414 GLU HB3 . 34537 1 946 . 1 . 1 75 75 GLU HG2 H 1 2.547 0.000 . . . . . . A 414 GLU HG2 . 34537 1 947 . 1 . 1 75 75 GLU HG3 H 1 2.314 0.000 . . . . . . A 414 GLU HG3 . 34537 1 948 . 1 . 1 75 75 GLU C C 13 179.992 0.000 . . . . . . A 414 GLU C . 34537 1 949 . 1 . 1 75 75 GLU CA C 13 60.046 0.086 . . . . . . A 414 GLU CA . 34537 1 950 . 1 . 1 75 75 GLU CB C 13 29.915 0.049 . . . . . . A 414 GLU CB . 34537 1 951 . 1 . 1 75 75 GLU CG C 13 36.598 0.039 . . . . . . A 414 GLU CG . 34537 1 952 . 1 . 1 75 75 GLU N N 15 121.418 0.019 . . . . . . A 414 GLU N . 34537 1 953 . 1 . 1 76 76 LYS H H 1 8.716 0.007 . . . . . . A 415 LYS H . 34537 1 954 . 1 . 1 76 76 LYS HA H 1 4.186 0.000 . . . . . . A 415 LYS HA . 34537 1 955 . 1 . 1 76 76 LYS HB2 H 1 1.816 0.000 . . . . . . A 415 LYS HB2 . 34537 1 956 . 1 . 1 76 76 LYS HB3 H 1 1.816 0.000 . . . . . . A 415 LYS HB3 . 34537 1 957 . 1 . 1 76 76 LYS HG2 H 1 1.745 0.000 . . . . . . A 415 LYS HG2 . 34537 1 958 . 1 . 1 76 76 LYS HG3 H 1 1.603 0.000 . . . . . . A 415 LYS HG3 . 34537 1 959 . 1 . 1 76 76 LYS HD2 H 1 1.649 0.000 . . . . . . A 415 LYS HD2 . 34537 1 960 . 1 . 1 76 76 LYS HD3 H 1 1.408 0.009 . . . . . . A 415 LYS HD3 . 34537 1 961 . 1 . 1 76 76 LYS HE2 H 1 3.022 0.000 . . . . . . A 415 LYS HE2 . 34537 1 962 . 1 . 1 76 76 LYS HE3 H 1 2.879 0.000 . . . . . . A 415 LYS HE3 . 34537 1 963 . 1 . 1 76 76 LYS C C 13 179.703 0.000 . . . . . . A 415 LYS C . 34537 1 964 . 1 . 1 76 76 LYS CA C 13 60.417 0.091 . . . . . . A 415 LYS CA . 34537 1 965 . 1 . 1 76 76 LYS CB C 13 34.247 0.074 . . . . . . A 415 LYS CB . 34537 1 966 . 1 . 1 76 76 LYS CG C 13 27.201 0.058 . . . . . . A 415 LYS CG . 34537 1 967 . 1 . 1 76 76 LYS CD C 13 29.367 0.018 . . . . . . A 415 LYS CD . 34537 1 968 . 1 . 1 76 76 LYS CE C 13 42.067 0.029 . . . . . . A 415 LYS CE . 34537 1 969 . 1 . 1 76 76 LYS N N 15 119.848 0.015 . . . . . . A 415 LYS N . 34537 1 970 . 1 . 1 77 77 SER H H 1 8.750 0.003 . . . . . . A 416 SER H . 34537 1 971 . 1 . 1 77 77 SER HA H 1 4.056 0.000 . . . . . . A 416 SER HA . 34537 1 972 . 1 . 1 77 77 SER HB2 H 1 3.957 0.000 . . . . . . A 416 SER HB2 . 34537 1 973 . 1 . 1 77 77 SER HB3 H 1 3.813 0.000 . . . . . . A 416 SER HB3 . 34537 1 974 . 1 . 1 77 77 SER HG H 1 4.285 0.000 . . . . . . A 416 SER HG . 34537 1 975 . 1 . 1 77 77 SER C C 13 176.573 0.000 . . . . . . A 416 SER C . 34537 1 976 . 1 . 1 77 77 SER CA C 13 63.277 0.020 . . . . . . A 416 SER CA . 34537 1 977 . 1 . 1 77 77 SER CB C 13 62.697 0.000 . . . . . . A 416 SER CB . 34537 1 978 . 1 . 1 77 77 SER N N 15 114.199 0.047 . . . . . . A 416 SER N . 34537 1 979 . 1 . 1 78 78 THR H H 1 8.001 0.004 . . . . . . A 417 THR H . 34537 1 980 . 1 . 1 78 78 THR HA H 1 3.841 0.000 . . . . . . A 417 THR HA . 34537 1 981 . 1 . 1 78 78 THR HB H 1 4.439 0.000 . . . . . . A 417 THR HB . 34537 1 982 . 1 . 1 78 78 THR HG1 H 1 5.617 0.000 . . . . . . A 417 THR HG1 . 34537 1 983 . 1 . 1 78 78 THR HG21 H 1 1.338 0.005 . . . . . . A 417 THR HG21 . 34537 1 984 . 1 . 1 78 78 THR HG22 H 1 1.338 0.005 . . . . . . A 417 THR HG22 . 34537 1 985 . 1 . 1 78 78 THR HG23 H 1 1.338 0.005 . . . . . . A 417 THR HG23 . 34537 1 986 . 1 . 1 78 78 THR C C 13 175.521 0.000 . . . . . . A 417 THR C . 34537 1 987 . 1 . 1 78 78 THR CA C 13 68.187 0.005 . . . . . . A 417 THR CA . 34537 1 988 . 1 . 1 78 78 THR CB C 13 69.046 0.000 . . . . . . A 417 THR CB . 34537 1 989 . 1 . 1 78 78 THR CG2 C 13 21.165 0.008 . . . . . . A 417 THR CG2 . 34537 1 990 . 1 . 1 78 78 THR N N 15 120.978 0.039 . . . . . . A 417 THR N . 34537 1 991 . 1 . 1 79 79 MET H H 1 7.813 0.014 . . . . . . A 418 MET H . 34537 1 992 . 1 . 1 79 79 MET HA H 1 4.193 0.000 . . . . . . A 418 MET HA . 34537 1 993 . 1 . 1 79 79 MET HB2 H 1 2.286 0.000 . . . . . . A 418 MET HB2 . 34537 1 994 . 1 . 1 79 79 MET HB3 H 1 2.286 0.000 . . . . . . A 418 MET HB3 . 34537 1 995 . 1 . 1 79 79 MET HG2 H 1 2.832 0.000 . . . . . . A 418 MET HG2 . 34537 1 996 . 1 . 1 79 79 MET HG3 H 1 2.606 0.000 . . . . . . A 418 MET HG3 . 34537 1 997 . 1 . 1 79 79 MET HE1 H 1 2.138 0.000 . . . . . . A 418 MET HE1 . 34537 1 998 . 1 . 1 79 79 MET HE2 H 1 2.138 0.000 . . . . . . A 418 MET HE2 . 34537 1 999 . 1 . 1 79 79 MET HE3 H 1 2.138 0.000 . . . . . . A 418 MET HE3 . 34537 1 1000 . 1 . 1 79 79 MET C C 13 179.636 0.000 . . . . . . A 418 MET C . 34537 1 1001 . 1 . 1 79 79 MET CA C 13 59.391 0.060 . . . . . . A 418 MET CA . 34537 1 1002 . 1 . 1 79 79 MET CB C 13 32.095 0.000 . . . . . . A 418 MET CB . 34537 1 1003 . 1 . 1 79 79 MET CG C 13 32.099 0.030 . . . . . . A 418 MET CG . 34537 1 1004 . 1 . 1 79 79 MET CE C 13 17.185 0.000 . . . . . . A 418 MET CE . 34537 1 1005 . 1 . 1 79 79 MET N N 15 120.883 0.066 . . . . . . A 418 MET N . 34537 1 1006 . 1 . 1 80 80 LEU H H 1 8.085 0.002 . . . . . . A 419 LEU H . 34537 1 1007 . 1 . 1 80 80 LEU HA H 1 3.974 0.000 . . . . . . A 419 LEU HA . 34537 1 1008 . 1 . 1 80 80 LEU HB2 H 1 1.969 0.000 . . . . . . A 419 LEU HB2 . 34537 1 1009 . 1 . 1 80 80 LEU HB3 H 1 1.369 0.000 . . . . . . A 419 LEU HB3 . 34537 1 1010 . 1 . 1 80 80 LEU HG H 1 1.932 0.000 . . . . . . A 419 LEU HG . 34537 1 1011 . 1 . 1 80 80 LEU HD11 H 1 1.026 0.000 . . . . . . A 419 LEU HD11 . 34537 1 1012 . 1 . 1 80 80 LEU HD12 H 1 1.026 0.000 . . . . . . A 419 LEU HD12 . 34537 1 1013 . 1 . 1 80 80 LEU HD13 H 1 1.026 0.000 . . . . . . A 419 LEU HD13 . 34537 1 1014 . 1 . 1 80 80 LEU HD21 H 1 0.848 0.000 . . . . . . A 419 LEU HD21 . 34537 1 1015 . 1 . 1 80 80 LEU HD22 H 1 0.848 0.000 . . . . . . A 419 LEU HD22 . 34537 1 1016 . 1 . 1 80 80 LEU HD23 H 1 0.848 0.000 . . . . . . A 419 LEU HD23 . 34537 1 1017 . 1 . 1 80 80 LEU C C 13 177.658 0.000 . . . . . . A 419 LEU C . 34537 1 1018 . 1 . 1 80 80 LEU CA C 13 57.918 0.084 . . . . . . A 419 LEU CA . 34537 1 1019 . 1 . 1 80 80 LEU CB C 13 43.622 0.069 . . . . . . A 419 LEU CB . 34537 1 1020 . 1 . 1 80 80 LEU CG C 13 27.284 0.000 . . . . . . A 419 LEU CG . 34537 1 1021 . 1 . 1 80 80 LEU CD1 C 13 27.093 0.000 . . . . . . A 419 LEU CD1 . 34537 1 1022 . 1 . 1 80 80 LEU CD2 C 13 23.305 0.000 . . . . . . A 419 LEU CD2 . 34537 1 1023 . 1 . 1 80 80 LEU N N 15 120.466 0.015 . . . . . . A 419 LEU N . 34537 1 1024 . 1 . 1 81 81 TYR H H 1 9.114 0.015 . . . . . . A 420 TYR H . 34537 1 1025 . 1 . 1 81 81 TYR HA H 1 4.056 0.000 . . . . . . A 420 TYR HA . 34537 1 1026 . 1 . 1 81 81 TYR HB2 H 1 3.038 0.000 . . . . . . A 420 TYR HB2 . 34537 1 1027 . 1 . 1 81 81 TYR HB3 H 1 3.038 0.000 . . . . . . A 420 TYR HB3 . 34537 1 1028 . 1 . 1 81 81 TYR HD1 H 1 7.156 0.000 . . . . . . A 420 TYR HD1 . 34537 1 1029 . 1 . 1 81 81 TYR HD2 H 1 7.156 0.000 . . . . . . A 420 TYR HD2 . 34537 1 1030 . 1 . 1 81 81 TYR HE1 H 1 6.778 0.000 . . . . . . A 420 TYR HE1 . 34537 1 1031 . 1 . 1 81 81 TYR HE2 H 1 6.778 0.000 . . . . . . A 420 TYR HE2 . 34537 1 1032 . 1 . 1 81 81 TYR C C 13 176.519 0.000 . . . . . . A 420 TYR C . 34537 1 1033 . 1 . 1 81 81 TYR CA C 13 62.803 0.042 . . . . . . A 420 TYR CA . 34537 1 1034 . 1 . 1 81 81 TYR CB C 13 38.459 0.077 . . . . . . A 420 TYR CB . 34537 1 1035 . 1 . 1 81 81 TYR CD1 C 13 133.085 0.000 . . . . . . A 420 TYR CD1 . 34537 1 1036 . 1 . 1 81 81 TYR CE1 C 13 118.150 0.000 . . . . . . A 420 TYR CE1 . 34537 1 1037 . 1 . 1 81 81 TYR N N 15 120.370 0.014 . . . . . . A 420 TYR N . 34537 1 1038 . 1 . 1 82 82 ASN H H 1 8.241 0.002 . . . . . . A 421 ASN H . 34537 1 1039 . 1 . 1 82 82 ASN HA H 1 4.135 0.000 . . . . . . A 421 ASN HA . 34537 1 1040 . 1 . 1 82 82 ASN HB2 H 1 2.911 0.000 . . . . . . A 421 ASN HB2 . 34537 1 1041 . 1 . 1 82 82 ASN HB3 H 1 2.724 0.000 . . . . . . A 421 ASN HB3 . 34537 1 1042 . 1 . 1 82 82 ASN HD21 H 1 7.583 0.000 . . . . . . A 421 ASN HD21 . 34537 1 1043 . 1 . 1 82 82 ASN HD22 H 1 7.005 0.000 . . . . . . A 421 ASN HD22 . 34537 1 1044 . 1 . 1 82 82 ASN C C 13 177.187 0.000 . . . . . . A 421 ASN C . 34537 1 1045 . 1 . 1 82 82 ASN CA C 13 56.086 0.108 . . . . . . A 421 ASN CA . 34537 1 1046 . 1 . 1 82 82 ASN CB C 13 37.700 0.037 . . . . . . A 421 ASN CB . 34537 1 1047 . 1 . 1 82 82 ASN N N 15 115.824 0.009 . . . . . . A 421 ASN N . 34537 1 1048 . 1 . 1 82 82 ASN ND2 N 15 111.913 0.035 . . . . . . A 421 ASN ND2 . 34537 1 1049 . 1 . 1 83 83 LYS H H 1 7.759 0.001 . . . . . . A 422 LYS H . 34537 1 1050 . 1 . 1 83 83 LYS HA H 1 3.918 0.000 . . . . . . A 422 LYS HA . 34537 1 1051 . 1 . 1 83 83 LYS HB2 H 1 1.790 0.000 . . . . . . A 422 LYS HB2 . 34537 1 1052 . 1 . 1 83 83 LYS HB3 H 1 1.722 0.000 . . . . . . A 422 LYS HB3 . 34537 1 1053 . 1 . 1 83 83 LYS HG2 H 1 1.340 0.000 . . . . . . A 422 LYS HG2 . 34537 1 1054 . 1 . 1 83 83 LYS HG3 H 1 0.874 0.000 . . . . . . A 422 LYS HG3 . 34537 1 1055 . 1 . 1 83 83 LYS HD2 H 1 1.513 0.000 . . . . . . A 422 LYS HD2 . 34537 1 1056 . 1 . 1 83 83 LYS HD3 H 1 1.338 0.000 . . . . . . A 422 LYS HD3 . 34537 1 1057 . 1 . 1 83 83 LYS HE2 H 1 2.774 0.000 . . . . . . A 422 LYS HE2 . 34537 1 1058 . 1 . 1 83 83 LYS HE3 H 1 2.774 0.000 . . . . . . A 422 LYS HE3 . 34537 1 1059 . 1 . 1 83 83 LYS C C 13 179.135 0.000 . . . . . . A 422 LYS C . 34537 1 1060 . 1 . 1 83 83 LYS CA C 13 59.570 0.043 . . . . . . A 422 LYS CA . 34537 1 1061 . 1 . 1 83 83 LYS CB C 13 32.548 0.063 . . . . . . A 422 LYS CB . 34537 1 1062 . 1 . 1 83 83 LYS CG C 13 24.898 0.052 . . . . . . A 422 LYS CG . 34537 1 1063 . 1 . 1 83 83 LYS CD C 13 29.970 0.002 . . . . . . A 422 LYS CD . 34537 1 1064 . 1 . 1 83 83 LYS CE C 13 42.040 0.000 . . . . . . A 422 LYS CE . 34537 1 1065 . 1 . 1 83 83 LYS N N 15 120.499 0.057 . . . . . . A 422 LYS N . 34537 1 1066 . 1 . 1 84 84 PHE H H 1 7.975 0.007 . . . . . . A 423 PHE H . 34537 1 1067 . 1 . 1 84 84 PHE HA H 1 4.385 0.000 . . . . . . A 423 PHE HA . 34537 1 1068 . 1 . 1 84 84 PHE HB2 H 1 2.809 0.000 . . . . . . A 423 PHE HB2 . 34537 1 1069 . 1 . 1 84 84 PHE HB3 H 1 3.014 0.000 . . . . . . A 423 PHE HB3 . 34537 1 1070 . 1 . 1 84 84 PHE HD1 H 1 7.235 0.000 . . . . . . A 423 PHE HD1 . 34537 1 1071 . 1 . 1 84 84 PHE HD2 H 1 7.235 0.000 . . . . . . A 423 PHE HD2 . 34537 1 1072 . 1 . 1 84 84 PHE HE1 H 1 7.064 0.000 . . . . . . A 423 PHE HE1 . 34537 1 1073 . 1 . 1 84 84 PHE HE2 H 1 7.064 0.000 . . . . . . A 423 PHE HE2 . 34537 1 1074 . 1 . 1 84 84 PHE HZ H 1 7.104 0.000 . . . . . . A 423 PHE HZ . 34537 1 1075 . 1 . 1 84 84 PHE C C 13 177.656 0.000 . . . . . . A 423 PHE C . 34537 1 1076 . 1 . 1 84 84 PHE CA C 13 60.802 0.010 . . . . . . A 423 PHE CA . 34537 1 1077 . 1 . 1 84 84 PHE CB C 13 39.041 0.093 . . . . . . A 423 PHE CB . 34537 1 1078 . 1 . 1 84 84 PHE CD1 C 13 131.534 0.000 . . . . . . A 423 PHE CD1 . 34537 1 1079 . 1 . 1 84 84 PHE CE1 C 13 130.135 0.000 . . . . . . A 423 PHE CE1 . 34537 1 1080 . 1 . 1 84 84 PHE CZ C 13 128.930 0.000 . . . . . . A 423 PHE CZ . 34537 1 1081 . 1 . 1 84 84 PHE N N 15 117.114 0.111 . . . . . . A 423 PHE N . 34537 1 1082 . 1 . 1 85 85 LYS H H 1 8.649 0.015 . . . . . . A 424 LYS H . 34537 1 1083 . 1 . 1 85 85 LYS HA H 1 3.902 0.000 . . . . . . A 424 LYS HA . 34537 1 1084 . 1 . 1 85 85 LYS HB2 H 1 1.433 0.000 . . . . . . A 424 LYS HB2 . 34537 1 1085 . 1 . 1 85 85 LYS HB3 H 1 1.433 0.000 . . . . . . A 424 LYS HB3 . 34537 1 1086 . 1 . 1 85 85 LYS HG2 H 1 1.233 0.000 . . . . . . A 424 LYS HG2 . 34537 1 1087 . 1 . 1 85 85 LYS HG3 H 1 1.233 0.000 . . . . . . A 424 LYS HG3 . 34537 1 1088 . 1 . 1 85 85 LYS HD2 H 1 1.607 0.000 . . . . . . A 424 LYS HD2 . 34537 1 1089 . 1 . 1 85 85 LYS HD3 H 1 1.504 0.000 . . . . . . A 424 LYS HD3 . 34537 1 1090 . 1 . 1 85 85 LYS HE2 H 1 2.969 0.000 . . . . . . A 424 LYS HE2 . 34537 1 1091 . 1 . 1 85 85 LYS HE3 H 1 2.969 0.000 . . . . . . A 424 LYS HE3 . 34537 1 1092 . 1 . 1 85 85 LYS C C 13 178.958 0.000 . . . . . . A 424 LYS C . 34537 1 1093 . 1 . 1 85 85 LYS CA C 13 59.267 0.021 . . . . . . A 424 LYS CA . 34537 1 1094 . 1 . 1 85 85 LYS CB C 13 31.271 0.059 . . . . . . A 424 LYS CB . 34537 1 1095 . 1 . 1 85 85 LYS CG C 13 23.969 0.009 . . . . . . A 424 LYS CG . 34537 1 1096 . 1 . 1 85 85 LYS CD C 13 29.105 0.011 . . . . . . A 424 LYS CD . 34537 1 1097 . 1 . 1 85 85 LYS CE C 13 42.217 0.000 . . . . . . A 424 LYS CE . 34537 1 1098 . 1 . 1 85 85 LYS N N 15 119.915 0.038 . . . . . . A 424 LYS N . 34537 1 1099 . 1 . 1 86 86 ASN H H 1 7.910 0.002 . . . . . . A 425 ASN H . 34537 1 1100 . 1 . 1 86 86 ASN HA H 1 4.563 0.000 . . . . . . A 425 ASN HA . 34537 1 1101 . 1 . 1 86 86 ASN HB2 H 1 2.797 0.002 . . . . . . A 425 ASN HB2 . 34537 1 1102 . 1 . 1 86 86 ASN HB3 H 1 2.797 0.002 . . . . . . A 425 ASN HB3 . 34537 1 1103 . 1 . 1 86 86 ASN HD21 H 1 7.491 0.000 . . . . . . A 425 ASN HD21 . 34537 1 1104 . 1 . 1 86 86 ASN HD22 H 1 6.877 0.000 . . . . . . A 425 ASN HD22 . 34537 1 1105 . 1 . 1 86 86 ASN C C 13 176.841 0.000 . . . . . . A 425 ASN C . 34537 1 1106 . 1 . 1 86 86 ASN CA C 13 55.113 0.050 . . . . . . A 425 ASN CA . 34537 1 1107 . 1 . 1 86 86 ASN CB C 13 38.329 0.014 . . . . . . A 425 ASN CB . 34537 1 1108 . 1 . 1 86 86 ASN N N 15 116.006 0.063 . . . . . . A 425 ASN N . 34537 1 1109 . 1 . 1 86 86 ASN ND2 N 15 112.328 0.000 . . . . . . A 425 ASN ND2 . 34537 1 1110 . 1 . 1 87 87 MET H H 1 7.694 0.009 . . . . . . A 426 MET H . 34537 1 1111 . 1 . 1 87 87 MET HA H 1 4.153 0.000 . . . . . . A 426 MET HA . 34537 1 1112 . 1 . 1 87 87 MET HB2 H 1 1.994 0.000 . . . . . . A 426 MET HB2 . 34537 1 1113 . 1 . 1 87 87 MET HB3 H 1 1.812 0.000 . . . . . . A 426 MET HB3 . 34537 1 1114 . 1 . 1 87 87 MET HG2 H 1 2.602 0.000 . . . . . . A 426 MET HG2 . 34537 1 1115 . 1 . 1 87 87 MET HG3 H 1 2.382 0.000 . . . . . . A 426 MET HG3 . 34537 1 1116 . 1 . 1 87 87 MET HE1 H 1 1.888 0.000 . . . . . . A 426 MET HE1 . 34537 1 1117 . 1 . 1 87 87 MET HE2 H 1 1.888 0.000 . . . . . . A 426 MET HE2 . 34537 1 1118 . 1 . 1 87 87 MET HE3 H 1 1.888 0.000 . . . . . . A 426 MET HE3 . 34537 1 1119 . 1 . 1 87 87 MET C C 13 176.594 0.000 . . . . . . A 426 MET C . 34537 1 1120 . 1 . 1 87 87 MET CA C 13 58.083 0.134 . . . . . . A 426 MET CA . 34537 1 1121 . 1 . 1 87 87 MET CB C 13 33.124 0.034 . . . . . . A 426 MET CB . 34537 1 1122 . 1 . 1 87 87 MET CG C 13 32.142 0.017 . . . . . . A 426 MET CG . 34537 1 1123 . 1 . 1 87 87 MET CE C 13 17.138 0.000 . . . . . . A 426 MET CE . 34537 1 1124 . 1 . 1 87 87 MET N N 15 118.416 0.090 . . . . . . A 426 MET N . 34537 1 1125 . 1 . 1 88 88 PHE H H 1 7.557 0.006 . . . . . . A 427 PHE H . 34537 1 1126 . 1 . 1 88 88 PHE HA H 1 4.614 0.000 . . . . . . A 427 PHE HA . 34537 1 1127 . 1 . 1 88 88 PHE HB2 H 1 3.309 0.000 . . . . . . A 427 PHE HB2 . 34537 1 1128 . 1 . 1 88 88 PHE HB3 H 1 3.004 0.000 . . . . . . A 427 PHE HB3 . 34537 1 1129 . 1 . 1 88 88 PHE HD1 H 1 7.326 0.000 . . . . . . A 427 PHE HD1 . 34537 1 1130 . 1 . 1 88 88 PHE HD2 H 1 7.326 0.000 . . . . . . A 427 PHE HD2 . 34537 1 1131 . 1 . 1 88 88 PHE HE1 H 1 7.219 0.000 . . . . . . A 427 PHE HE1 . 34537 1 1132 . 1 . 1 88 88 PHE HE2 H 1 7.219 0.000 . . . . . . A 427 PHE HE2 . 34537 1 1133 . 1 . 1 88 88 PHE HZ H 1 7.072 0.000 . . . . . . A 427 PHE HZ . 34537 1 1134 . 1 . 1 88 88 PHE C C 13 175.955 0.000 . . . . . . A 427 PHE C . 34537 1 1135 . 1 . 1 88 88 PHE CA C 13 58.007 0.020 . . . . . . A 427 PHE CA . 34537 1 1136 . 1 . 1 88 88 PHE CB C 13 39.040 0.002 . . . . . . A 427 PHE CB . 34537 1 1137 . 1 . 1 88 88 PHE CD1 C 13 131.975 0.000 . . . . . . A 427 PHE CD1 . 34537 1 1138 . 1 . 1 88 88 PHE CE1 C 13 131.037 0.000 . . . . . . A 427 PHE CE1 . 34537 1 1139 . 1 . 1 88 88 PHE CZ C 13 129.284 0.000 . . . . . . A 427 PHE CZ . 34537 1 1140 . 1 . 1 88 88 PHE N N 15 115.655 0.034 . . . . . . A 427 PHE N . 34537 1 1141 . 1 . 1 89 89 LEU H H 1 7.764 0.025 . . . . . . A 428 LEU H . 34537 1 1142 . 1 . 1 89 89 LEU HA H 1 4.386 0.000 . . . . . . A 428 LEU HA . 34537 1 1143 . 1 . 1 89 89 LEU HB2 H 1 1.753 0.000 . . . . . . A 428 LEU HB2 . 34537 1 1144 . 1 . 1 89 89 LEU HB3 H 1 1.614 0.000 . . . . . . A 428 LEU HB3 . 34537 1 1145 . 1 . 1 89 89 LEU HG H 1 1.649 0.000 . . . . . . A 428 LEU HG . 34537 1 1146 . 1 . 1 89 89 LEU HD11 H 1 0.931 0.000 . . . . . . A 428 LEU HD11 . 34537 1 1147 . 1 . 1 89 89 LEU HD12 H 1 0.931 0.000 . . . . . . A 428 LEU HD12 . 34537 1 1148 . 1 . 1 89 89 LEU HD13 H 1 0.931 0.000 . . . . . . A 428 LEU HD13 . 34537 1 1149 . 1 . 1 89 89 LEU HD21 H 1 0.893 0.000 . . . . . . A 428 LEU HD21 . 34537 1 1150 . 1 . 1 89 89 LEU HD22 H 1 0.893 0.000 . . . . . . A 428 LEU HD22 . 34537 1 1151 . 1 . 1 89 89 LEU HD23 H 1 0.893 0.000 . . . . . . A 428 LEU HD23 . 34537 1 1152 . 1 . 1 89 89 LEU C C 13 177.451 0.000 . . . . . . A 428 LEU C . 34537 1 1153 . 1 . 1 89 89 LEU CA C 13 55.722 0.085 . . . . . . A 428 LEU CA . 34537 1 1154 . 1 . 1 89 89 LEU CB C 13 42.145 0.067 . . . . . . A 428 LEU CB . 34537 1 1155 . 1 . 1 89 89 LEU CG C 13 26.946 0.084 . . . . . . A 428 LEU CG . 34537 1 1156 . 1 . 1 89 89 LEU CD1 C 13 25.170 0.037 . . . . . . A 428 LEU CD1 . 34537 1 1157 . 1 . 1 89 89 LEU CD2 C 13 23.524 0.028 . . . . . . A 428 LEU CD2 . 34537 1 1158 . 1 . 1 89 89 LEU N N 15 120.758 0.017 . . . . . . A 428 LEU N . 34537 1 1159 . 1 . 1 90 90 VAL H H 1 7.927 0.008 . . . . . . A 429 VAL H . 34537 1 1160 . 1 . 1 90 90 VAL HA H 1 4.155 0.000 . . . . . . A 429 VAL HA . 34537 1 1161 . 1 . 1 90 90 VAL HB H 1 2.135 0.000 . . . . . . A 429 VAL HB . 34537 1 1162 . 1 . 1 90 90 VAL HG11 H 1 0.963 0.000 . . . . . . A 429 VAL HG11 . 34537 1 1163 . 1 . 1 90 90 VAL HG12 H 1 0.963 0.000 . . . . . . A 429 VAL HG12 . 34537 1 1164 . 1 . 1 90 90 VAL HG13 H 1 0.963 0.000 . . . . . . A 429 VAL HG13 . 34537 1 1165 . 1 . 1 90 90 VAL HG21 H 1 0.963 0.000 . . . . . . A 429 VAL HG21 . 34537 1 1166 . 1 . 1 90 90 VAL HG22 H 1 0.963 0.000 . . . . . . A 429 VAL HG22 . 34537 1 1167 . 1 . 1 90 90 VAL HG23 H 1 0.963 0.000 . . . . . . A 429 VAL HG23 . 34537 1 1168 . 1 . 1 90 90 VAL C C 13 176.743 0.000 . . . . . . A 429 VAL C . 34537 1 1169 . 1 . 1 90 90 VAL CA C 13 62.692 0.001 . . . . . . A 429 VAL CA . 34537 1 1170 . 1 . 1 90 90 VAL CB C 13 32.810 0.004 . . . . . . A 429 VAL CB . 34537 1 1171 . 1 . 1 90 90 VAL CG1 C 13 21.401 0.001 . . . . . . A 429 VAL CG1 . 34537 1 1172 . 1 . 1 90 90 VAL CG2 C 13 20.695 0.000 . . . . . . A 429 VAL CG2 . 34537 1 1173 . 1 . 1 90 90 VAL N N 15 118.967 0.022 . . . . . . A 429 VAL N . 34537 1 1174 . 1 . 1 91 91 GLY H H 1 8.311 0.020 . . . . . . A 430 GLY H . 34537 1 1175 . 1 . 1 91 91 GLY HA2 H 1 3.981 0.000 . . . . . . A 430 GLY HA2 . 34537 1 1176 . 1 . 1 91 91 GLY HA3 H 1 3.981 0.000 . . . . . . A 430 GLY HA3 . 34537 1 1177 . 1 . 1 91 91 GLY C C 13 173.084 0.000 . . . . . . A 430 GLY C . 34537 1 1178 . 1 . 1 91 91 GLY CA C 13 45.373 0.009 . . . . . . A 430 GLY CA . 34537 1 1179 . 1 . 1 91 91 GLY N N 15 111.926 0.107 . . . . . . A 430 GLY N . 34537 1 1180 . 1 . 1 92 92 GLU H H 1 7.870 0.006 . . . . . . A 431 GLU H . 34537 1 1181 . 1 . 1 92 92 GLU HA H 1 4.165 0.000 . . . . . . A 431 GLU HA . 34537 1 1182 . 1 . 1 92 92 GLU HB2 H 1 2.065 0.000 . . . . . . A 431 GLU HB2 . 34537 1 1183 . 1 . 1 92 92 GLU HB3 H 1 1.894 0.000 . . . . . . A 431 GLU HB3 . 34537 1 1184 . 1 . 1 92 92 GLU HG2 H 1 2.207 0.002 . . . . . . A 431 GLU HG2 . 34537 1 1185 . 1 . 1 92 92 GLU HG3 H 1 2.207 0.002 . . . . . . A 431 GLU HG3 . 34537 1 1186 . 1 . 1 92 92 GLU CA C 13 57.906 0.030 . . . . . . A 431 GLU CA . 34537 1 1187 . 1 . 1 92 92 GLU CB C 13 31.347 0.000 . . . . . . A 431 GLU CB . 34537 1 1188 . 1 . 1 92 92 GLU CG C 13 36.704 0.015 . . . . . . A 431 GLU CG . 34537 1 1189 . 1 . 1 92 92 GLU N N 15 125.381 0.029 . . . . . . A 431 GLU N . 34537 1 stop_ save_